Caspofungin Impurity 15 CAS#: 2142583-72-8

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity 15
分子结构
CAS编号 2142583-72-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-((2R,6S,9S,11R,12S,14aS,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-aminoethyl)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11-dihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide
分子式 C52H88N10O14
分子量 1077.3
InChI
InChI Key
Canonical SMILES O=C([C@](NC([C@H](C[C@H]([C@H](N1)NCCN)O)NC(CCCCCCCCC(C)CC(C)CC)=O)=O)([H])[C@H](O)C)N(C[C@@H]2O)[C@](C2)([H])C(N[C@@](C(N[C@@](C(N(CCC3)[C@]3([H])C1=O)=O)([H])[C@H](O)CCN)=O)([H])[C@H](O)[C@H](C(C=C4)=CC=C4O)O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity 15 is chemically N-((2R,6S,9S,11R,12S,14aS,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-aminoethyl)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11-dihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide. Caspofungin Impurity 15 is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity 15 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Caspofungin Impurity 10 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity 10
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (10R,12S)-N-((2R,6S,9S,11R,12S,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide
分子式 C102H168N18O30
分子量 2126.6
InChI
InChI Key
Canonical SMILES CC[C@@](C)([H])C[C@]([H])(C)CCCCCCCCC(N[C@@](C(N[C@@](C(N(C[C@@](O)([H])C1)[C@]1([H])C(N[C@]([C@]([H])(O)[C@](O)([H])C2=CC=C(O)C=C2)([H])C(N[C@]([C@]([H])(O)CCN)([H])C(N3[C@@]4([H])[C@](O)([H])CC3)=O)=O)=O)=O)([H])[C@@](O)([H])C)=O)([H])C[C@](O)([H])[C@](NCCN[C@@]5([H])NC(C6N(C([C@](NC([C@@]([C@@](O)([H])[C@](O)([H])C7=CC=C(O)C=C7)([H])NC([C@@]8([H])N(C([C@@]([C@]([H])(O)C)([H])NC([C@@]([H])(NC(CCCCCCCC[C@](C)([H])C[C@@]([H])(C)CC)=O)C[C@]5(O)[H])=O)=O)C[C@@](O)([H])C8)=O)=O)([H])[C@]([H])(O)CCN)=O)CC[C@]6([H])O)=O)([H])NC4=O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity 10 is chemically (10R,12S)-N-((2R,6S,9S,11R,12S,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide. Caspofungin Impurity 10 is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity 10 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Caspofungin Impurity 6 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity 6
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (10R,12S)-N-((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-aminoethyl)amino)-23-((1S,2R)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide
分子式 C52H88N10O15
分子量 1093.3
InChI
InChI Key
Canonical SMILES O=C(N[C@H](C(N1[C@H]2C[C@@H](O)C1)=O)[C@H](O)C)[C@@H](NC(CCCCCCCC[C@@H](C)C[C@@H](C)CC)=O)C[C@@H](O)[C@@H](NCCN)NC([C@@H]3[C@@H](O)CCN3C([C@H]([C@H](O)CCN)NC([C@H]([C@H](O)[C@H](O)C4=CC=C(O)C=C4)NC2=O)=O)=O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity 6 is chemically (10R,12S)-N-((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-aminoethyl)amino)-23-((1S,2R)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide. Caspofungin Impurity 6 is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity 6 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Pneumocandin B0 Serine Analog CAS#: 258510-40-6

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Pneumocandin B0 Serine Analog
分子结构
CAS编号 258510-40-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 (10R,12S)-N-((2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-((R)-3-Amino-1-hydroxy-3-oxopropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,12,15-tetrahydroxy-6-(hydroxymethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide
分子式 C49H78N8O17
分子量 1051.2
InChI
InChI Key
Canonical SMILES O[C@@H]1[C@@H](C[C@H](NC(CCCCCCCC[C@H](C[C@H](CC)C)C)=O)C(N[C@@H](CO)C(N2[C@@H](C[C@H](C2)O)C(N[C@@H]([C@@H]([C@H](C3=CC=C(C=C3)O)O)O)C(N[C@@H]([C@@H](CC(N)=O)O)C(N4[C@@H]([C@H](CC4)O)C(N1)=O)=O)=O)=O)=O)=O)O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Pneumocandin B0 Serine Analog is chemically (10R,12S)-N-((2R,6S,9S,11R,12R,14aS,15S,20S,23S,25aS)-20-((R)-3-Amino-1-hydroxy-3-oxopropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,12,15-tetrahydroxy-6-(hydroxymethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide. It is also known as 2-L-Serinepneumocandin B0. Pneumocandin B0 Serine Analog is supplied with detailed characterization data compliant with regulatory guideline. Pneumocandin B0 Serine Analog can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Caspofungin Impurity D CAS#: 314080-31-4

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity D
分子结构
CAS编号 314080-31-4
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2R,4R)-N-((2S,3R)-1-((2S,4R)-2-(((2S,3S,4S)-1-(((2S,3R)-5-Amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)carbamoyl)-4-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxobutan-2-yl)-1-(10,12-dimethyltetradecanoyl)-4,5-dihydroxypyrrolidine-2-carboxamide
分子式 C50H82N8O16
分子量 1051.2
InChI
InChI Key
Canonical SMILES O=C(N(C[C@H](O)C1)[C@@H]1C(N[C@]([C@H](O)[C@H](C2=CC=C(O)C=C2)O)([H])C(N[C@]([C@H](O)CCN)([H])C(N(CC[C@@H]3O)[C@@H]3C(N)=O)=O)=O)=O)[C@@]([C@H](O)C)([H])NC([C@@H](C[C@@H](O)C4O)N4C(CCCCCCCCC(C)CC(C)CC)=O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity D is chemically (2R,4R)-N-((2S,3R)-1-((2S,4R)-2-(((2S,3S,4S)-1-(((2S,3R)-5-Amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)carbamoyl)-4-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxobutan-2-yl)-1-(10,12-dimethyltetradecanoyl)-4,5-dihydroxypyrrolidine-2-carboxamide. Caspofungin Impurity D is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity D can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Caspofungin Impurity 13 CAS#: 1240611-93-1

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity 13
分子结构
CAS编号 1240611-93-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 (10R,12S)-N-((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-Amino-1-hydroxy-3-oxopropyl)-12-((2-aminoethyl)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide acetate
分子式 C54H90N10O18
分子量 1167.4
InChI
InChI Key
Canonical SMILES CC[C@H](C)C[C@H](C)CCCCCCCCC(N[C@@H]1C(N[C@@H]([C@H](O)C)C(N2[C@](C[C@@H](O)C2)([H])C(N[C@@H]([C@H](O)[C@@H](O)C3=CC=C(O)C=C3)C(N[C@@H]([C@H](O)CC(N)=O)C(N4[C@]([C@@H](O)CC4)([H])C(N[C@H](NCCN)[C@H](O)C1)=O)=O)=O)=O)=O)=O)=O.CC(O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity 13 is chemically (10R,12S)-N-((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-Amino-1-hydroxy-3-oxopropyl)-12-((2-aminoethyl)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide acetate. Caspofungin Impurity 13 is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity 13 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Caspofungin Impurity 14 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity 14
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2S,4R)-N-((2S,3S,4S)-1-(((2S,3R)-5-Amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)-1-(((2S,4R,E)-5-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)imino)-2-((10R,12S)-10,12-dimethyltetradecanamido)-4-hydroxypentanoyl)-L-threonyl)-4-hydroxypyrrolidine-2-carboxamide
分子式 C102H168N18O30
分子量 2126.6
InChI
InChI Key
Canonical SMILES O[C@H](C[C@H](NC(CCCCCCCC[C@@H](C)C[C@@H](C)CC)=O)C(N[C@@H]([C@H](O)C)C(N1[C@H](C(N[C@@H]([C@H](O)[C@@H](O)C2=CC=C(O)C=C2)C(N[C@H]3[C@H](O)CCN)=O)=O)C[C@@H](O)C1)=O)=O)[C@H](NC([C@@H]4[C@@H](O)CCN4C3=O)=O)NCC/N=C/[C@H](O)C[C@@H](C(N[C@@H]([C@H](O)C)C(N5[C@H](C(N[C@H](C(N[C@H](C(N6[C@H](C(N)=O)[C@@H](O)CC6)=O)[C@H](O)CCN)=O)[C@H](O)[C@@H](O)C7=CC=C(O)C=C7)=O)C[C@@H](O)C5)=O)=O)NC(CCCCCCCC[C@@H](C)C[C@@H](C)CC)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity 14 is chemically (2S,4R)-N-((2S,3S,4S)-1-(((2S,3R)-5-Amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)-1-(((2S,4R,E)-5-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)imino)-2-((10R,12S)-10,12-dimethyltetradecanamido)-4-hydroxypentanoyl)-L-threonyl)-4-hydroxypyrrolidine-2-carboxamide. Caspofungin Impurity 14 is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity 14 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

N-Nitroso Caspofungin CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 N-Nitroso Caspofungin
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (10R,12S)-N-((2R,9S,11R,12S,14aS,15S,20S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-aminoethyl)(nitroso)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide
分子式 C52H87N11O16
分子量 1122.3
InChI
InChI Key
Canonical SMILES [H][C@@]12C[C@@H](O)CN1C(=O)C(NC(=O)[C@H](C[C@@H](O)[C@@H](NC(=O)[C@]1([H])[C@@H](O)CCN1C(=O)[C@@]([H])(NC(=O)C(NC2=O)[C@H](O)[C@@H](O)C1=CC=C(O)C=C1)[C@H](O)CCN)N(CCN)N=O)NC(=O)CCCCCCCC[C@@H](C)C[C@@H](C)CC)[C@@H](C)O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
N-Nitroso Caspofungin is chemically (10R,12S)-N-((2R,9S,11R,12S,14aS,15S,20S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-12-((2-aminoethyl)(nitroso)amino)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-9-yl)-10,12-dimethyltetradecanamide. N-Nitroso Caspofungin is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Caspofungin can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Caspofungin Impurity F CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity F
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2S,4R)-N-((2S,3S,4S)-1-(((2S,3R)-5-amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)-1-(((2R,4S,Z)-5-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)imino)-2-((10R,12S)-10,12-dimethyltetradecanamido)-4-hydroxypentanoyl)-L-threonyl)-4-hydroxypyrrolidine-2-carboxamide
分子式 C102H168N18O30
分子量 2126.6
InChI
InChI Key
Canonical SMILES O[C@H](C[C@H](NC(CCCCCCCC[C@@H](C)C[C@@H](C)CC)=O)C(N[C@@H]([C@H](O)C)C(N1[C@H](C(N[C@@H]([C@H](O)[C@@H](O)C2=CC=C(O)C=C2)C(N[C@H]3[C@H](O)CCN)=O)=O)C[C@@H](O)C1)=O)=O)[C@H](NC([C@@H]4[C@@H](O)CCN4C3=O)=O)NCC/N=C[C@@H](O)C[C@H](C(N[C@@H]([C@H](O)C)C(N5[C@H](C(N[C@H](C(N[C@H](C(N6[C@H](C(N)=O)[C@@H](O)CC6)=O)[C@@H](CCN)O)=O)[C@H](O)[C@@H](O)C7=CC=C(O)C=C7)=O)C[C@@H](O)C5)=O)=O)NC(CCCCCCCC[C@@H](C)C[C@H](C)CC)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity F is chemically (2S,4R)-N-((2S,3S,4S)-1-(((2S,3R)-5-amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)-1-(((2R,4S,Z)-5-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)imino)-2-((10R,12S)-10,12-dimethyltetradecanamido)-4-hydroxypentanoyl)-L-threonyl)-4-hydroxypyrrolidine-2-carboxamide. Caspofungin Impurity F is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity F can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Caspofungin Impurity 12 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Caspofungin Impurity 12
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2S,4R)-N-((2S,3S,4S)-1-(((2S,3R)-5-amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)-1-(((S,3Z,5E)-5-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)imino)-2-((10R,12S)-10,12-dimethyltetradecanamido)pent-3-enoyl)-D-allothreonyl)-4-hydroxypyrrolidine-2-carboxamide
分子式 C102H166N18O29
分子量 2108.5
InChI
InChI Key
Canonical SMILES OC1=CC=C([C@H](O)[C@@H](O)[C@@H](C(N[C@H](C(N2[C@H](C(N)=O)[C@@H](O)CC2)=O)[C@H](O)CCN)=O)NC([C@@H]3C[C@@H](O)CN3C([C@@H]([C@H](O)C)NC([C@@H](NC(CCCCCCCC[C@@H](C)C[C@@H](C)CC)=O)/C=CC=NCCN[C@@H](NC([C@@H]4[C@@H](O)CCN4C5=O)=O)[C@H](O)C[C@H](NC(CCCCCCCC[C@@H](C)C[C@@H](C)CC)=O)C(N[C@@H]([C@@H](C)O)C(N6[C@H](C(N[C@@H]([C@H](O)[C@@H](O)C7=CC=C(O)C=C7)C(N[C@H]5[C@H](O)CCN)=O)=O)C[C@@H](O)C6)=O)=O)=O)=O)=O)C=C1

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Caspofungin Impurity 12 is chemically (2S,4R)-N-((2S,3S,4S)-1-(((2S,3R)-5-amino-1-((2S,3S)-2-carbamoyl-3-hydroxypyrrolidin-1-yl)-3-hydroxy-1-oxopentan-2-yl)amino)-3,4-dihydroxy-4-(4-hydroxyphenyl)-1-oxobutan-2-yl)-1-(((S,3Z,5E)-5-((2-(((2R,6S,9S,11R,12S,14aS,15S,20S,23S,25aS)-20-((R)-3-amino-1-hydroxypropyl)-23-((1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl)-9-((10R,12S)-10,12-dimethyltetradecanamido)-2,11,15-trihydroxy-6-((R)-1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2′,1′-l][1,4,7,10,13,16]hexaazacyclohenicosin-12-yl)amino)ethyl)imino)-2-((10R,12S)-10,12-dimethyltetradecanamido)pent-3-enoyl)-D-allothreonyl)-4-hydroxypyrrolidine-2-carboxamide. Caspofungin Impurity 12 is supplied with detailed characterization data compliant with regulatory guideline. Caspofungin Impurity 12 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Caspofungin. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.