Atosiban Nono Cyclic Impurity CAS#: N/A

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

Identification

英文名 Atosiban Nono Cyclic Impurity
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2S)-N1-((R)-3-((Acetamidomethyl)thio)-1-((S)-2-(((S)-5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-1-oxopropan-2-yl)-2-((2S,3S)-2-((3S)-2-((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanamido)-3-methylpentanamido)-3-hydroxybutanamido)succinamide
分子式 C46H74N12O13S2
分子量 1067.3
InChI
InChI Key
Canonical SMILES O=C([C@H](CC(N)=O)NC([C@H]([C@H](C)O)NC(C([C@H](CC)C)NC([C@@H](CC1=CC=C(C=C1)OCC)NC(CCS)=O)=O)=O)=O)N[C@H](C(N2[C@@H](CCC2)C(N[C@H](C(NCC(N)=O)=O)CCCN)=O)=O)CSCNC(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
Atosiban Nono Cyclic Impurity is chemically (2S)-N1-((R)-3-((Acetamidomethyl)thio)-1-((S)-2-(((S)-5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-1-oxopropan-2-yl)-2-((2S,3S)-2-((3S)-2-((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanamido)-3-methylpentanamido)-3-hydroxybutanamido)succinamide. Atosiban Nono Cyclic Impurity is supplied with detailed characterization data compliant with regulatory guideline. Atosiban Nono Cyclic Impurity 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 Atosiban. 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.

Atosiban Impurity 2 CAS#: 90779-69-4

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

Identification

英文名 Atosiban Impurity 2
分子结构
CAS编号 90779-69-4
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2S)-N-((S)-5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)-1-((4R,7S,10S,16R)-7-(2-amino-2-oxoethyl)-13-((S)-sec-butyl)-16-(4-ethoxybenzyl)-10-((R)-1-hydroxyethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)pyrrolidine-2-carboxamide
分子式 C43H67N11O12S2
分子量 994.2
InChI
InChI Key
Canonical SMILES O=C([C@H](CSSCCC(N[C@@H](C1=O)CC2=CC=C(OCC)C=C2)=O)NC([C@@H](NC([C@](NC(C(N1)[C@@H](C)CC)=O)([H])[C@H](O)C)=O)CC(N)=O)=O)N(CCC3)[C@@H]3C(N[C@@H](CCCN)C(NCC(N)=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
Atosiban Impurity 2 is chemically (2S)-N-((S)-5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)-1-((4R,7S,10S,16R)-7-(2-amino-2-oxoethyl)-13-((S)-sec-butyl)-16-(4-ethoxybenzyl)-10-((R)-1-hydroxyethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)pyrrolidine-2-carboxamide. Atosiban Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. Atosiban Impurity 2 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 Atosiban. 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.

Atosiban Impurity 1 CAS#: 2381861-04-5

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

Identification

英文名 Atosiban Impurity 1
分子结构
CAS编号 2381861-04-5
EINECS Number
MDL Number
Beilstein Registry Number
别名 (9H-fluoren-9-yl)methyl tert-butyl (5-((2-amino-2-oxoethyl)amino)-5-oxopentane-1,4-diyl)(R)-dicarbamate
分子式 C27H34N4O6
分子量 510.6
InChI
InChI Key
Canonical SMILES O=C(N[C@@H](C(NCC(N)=O)=O)CCCNC(OC(C)(C)C)=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

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
Atosiban Impurity 1 is chemically (9H-fluoren-9-yl)methyl tert-butyl (5-((2-amino-2-oxoethyl)amino)-5-oxopentane-1,4-diyl)(R)-dicarbamate. Atosiban Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Atosiban Impurity 1 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 Atosiban. 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.

Atosiban 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 Atosiban Impurity F
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (5-amino-2-((S)-1-(((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanoyl)-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl)pyrrolidine-2-carboxamido)pentanoyl)glycine
分子式 C43H68N10O13S2
分子量 997.2
InChI
InChI Key
Canonical SMILES SCCC(N[C@@H](C(N[C@]([C@@H](C)CC)([H])C(N[C@@](C(N[C@@H](CC(N)=O)C(N[C@H](C(N1CCC[C@H]1C(NC(CCCN)C(NCC(O)=O)=O)=O)=O)CS)=O)=O)([H])[C@H](O)C)=O)=O)CC2=CC=C(OCC)C=C2)=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
Atosiban Impurity F is chemically (5-amino-2-((S)-1-(((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanoyl)-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl)pyrrolidine-2-carboxamido)pentanoyl)glycine. Atosiban Impurity F is supplied with detailed characterization data compliant with regulatory guideline. Atosiban 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 Atosiban. 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.

Atosiban Impurity B CAS#: 960411-86-3

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

Identification

英文名 Atosiban Impurity B
分子结构
CAS编号 960411-86-3
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2S)-N1-((2R)-1-((2S)-2-((5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-3-mercapto-1-oxopropan-2-yl)-2-((2S,3R)-2-((2S,3S)-2-((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanamido)-3-methylpentanamido)-3-hydroxybutanamido)succinamide
分子式 C43H69N11O12S2
分子量 996.2
InChI
InChI Key
Canonical SMILES SCCC(N[C@@H](C(N[C@]([C@@H](C)CC)([H])C(N[C@@](C(N[C@@H](CC(N)=O)C(N[C@H](C(N1CCC[C@H]1C(NC(C(NCC(N)=O)=O)CCCN)=O)=O)CS)=O)=O)([H])[C@H](O)C)=O)=O)CC2=CC=C(OCC)C=C2)=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
Atosiban Impurity B is chemically (2S)-N1-((2R)-1-((2S)-2-((5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-3-mercapto-1-oxopropan-2-yl)-2-((2S,3R)-2-((2S,3S)-2-((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanamido)-3-methylpentanamido)-3-hydroxybutanamido)succinamide. Atosiban Impurity B is supplied with detailed characterization data compliant with regulatory guideline. Atosiban Impurity B 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 Atosiban. 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.

Atosiban Impurity D CAS#: N/A

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

Identification

英文名 Atosiban Impurity D
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N4-((2R)-1-((2S)-2-((5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-3-mercapto-1-oxopropan-2-yl)-N2-((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanoyl)-L-isoleucyl-L-threonyl-L-asparagine
分子式 C43H68N10O13S2
分子量 997.2
InChI
InChI Key
Canonical SMILES SCCC(N[C@@H](C(N[C@]([C@@H](C)CC)([H])C(N[C@@](C(N[C@@H](CC(N[C@H](C(N1CCC[C@H]1C(NC(CCCN)C(NCC(N)=O)=O)=O)=O)CS)=O)C(O)=O)=O)([H])[C@H](O)C)=O)=O)CC2=CC=C(OCC)C=C2)=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
Atosiban Impurity D is chemically N4-((2R)-1-((2S)-2-((5-amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-3-mercapto-1-oxopropan-2-yl)-N2-((R)-3-(4-ethoxyphenyl)-2-(3-mercaptopropanamido)propanoyl)-L-isoleucyl-L-threonyl-L-asparagine. Atosiban Impurity D is supplied with detailed characterization data compliant with regulatory guideline. Atosiban 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 Atosiban. 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.

Atosiban 1-8 Lactam Impurity CAS#: N/A

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

Identification

英文名 Atosiban 1-8 Lactam Impurity
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (S)-1-((4R,7S,10S,13S,16R)-7-(2-Amino-2-oxoethyl)-13-((S)-sec-butyl)-16-(4-ethoxybenzyl)-10-((R)-1-hydroxyethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)-N-((R)-2-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
分子式 C41H61N9O11S2
分子量 920.1
InChI
InChI Key
Canonical SMILES O=C([C@H]1N(C([C@@H](NC([C@H](CC(N)=O)NC([C@H]([C@H](O)C)NC([C@H]([C@@H](C)CC)NC([C@@H](CC2=CC=C(OCC)C=C2)N3)=O)=O)=O)=O)CSSCCC3=O)=O)CCC1)N[C@H]4C(NCCC4)=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
Atosiban 1-8 Lactam Impurity is chemically (S)-1-((4R,7S,10S,13S,16R)-7-(2-Amino-2-oxoethyl)-13-((S)-sec-butyl)-16-(4-ethoxybenzyl)-10-((R)-1-hydroxyethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)-N-((R)-2-oxopiperidin-3-yl)pyrrolidine-2-carboxamide. Atosiban 1-8 Lactam Impurity is supplied with detailed characterization data compliant with regulatory guideline. Atosiban 1-8 Lactam Impurity 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 Atosiban. 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.

Atosiban Acetate CAS#: 914453-95-5

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

Identification

英文名 Atosiban Acetate
分子结构
CAS编号 914453-95-5
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2S)-N-((S)-5-Amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)-1-((4R,7S,10S,16R)-7-(2-amino-2-oxoethyl)-13-((S)-sec-butyl)-16-(4-ethoxybenzyl)-10-((R)-1-hydroxyethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)pyrrolidine-2-carboxamide acetate
分子式 C43H67N11O12S2 : C2H4O2
分子量 994.2 : 60.1
InChI
InChI Key
Canonical SMILES O=C([C@H](CSSCCC(N[C@@H](C1=O)CC2=CC=C(OCC)C=C2)=O)NC([C@@H](NC([C@](NC(C(N1)[C@@H](C)CC)=O)([H])[C@H](O)C)=O)CC(N)=O)=O)N(CCC3)[C@@H]3C(N[C@@H](CCCN)C(NCC(N)=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 90779-69-4 (free base)
Use Pattern
Atosiban Acetate is chemically (2S)-N-((S)-5-Amino-1-((2-amino-2-oxoethyl)amino)-1-oxopentan-2-yl)-1-((4R,7S,10S,16R)-7-(2-amino-2-oxoethyl)-13-((S)-sec-butyl)-16-(4-ethoxybenzyl)-10-((R)-1-hydroxyethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carbonyl)pyrrolidine-2-carboxamide acetate. Atosiban Acetate is supplied with detailed characterization data compliant with regulatory guideline. Atosiban Acetate 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 Atosiban. 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.