N1-methyl-pseudouridine 5′-triphosphate (UTP), trisodium salt Solution CAS#: 21-20-16

By Janice Zhang,
Structure of N1-methyl-pseudouridine 5'-triphosphate (UTP), trisodium salt Solution
IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

英文名N1-methyl-pseudouridine 5′-triphosphate (UTP), trisodium salt Solution
IUPAC Name No data available
分子结构Structure of N1-methyl-pseudouridine 5'-triphosphate (UTP), trisodium salt Solution
CAS编号 21-20-16
EINECS NumberNo data available
MDL NumberNo data available
Beilstein Registry NumberNo data available
别名No data available
分子式No data available
分子量564.13
InChINo data available
InChI KeyNo data available
Canonical SMILESNo data available
Patent Information
No data available

Physical Data

AppearanceOff white powder
SolubilityNo data available
Flash PointNo data available
Refractive indexNo data available
SensitivityNo data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

GHS Hazard StatementsNot Classified
For more detailed information, please visit ECHA C&L website
Source: European Chemicals Agency (ECHA)
License Note: Use of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: “Source: European Chemicals Agency, http://echa.europa.eu/”. Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.
License URL: https://echa.europa.eu/web/guest/legal-notice
Record Name: (1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate
URL: https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/213446
Description: The information provided here is aggregated from the “Notified classification and labelling” from ECHA’s C&L Inventory. Read more: https://echa.europa.eu/information-on-chemicals/cl-inventory-database

Other Data

TransportationNONH for all modes of transport
Under the room temperature and away from light
HS CodeNo data available
StorageUnder the room temperature and away from light
Shelf Life1 year
Market PriceUSD

alpha,beta-methylene Adenosine 5′-triphosphate (sodium salt) CAS#: 1343364-54-4

By Janice Zhang,
Structure of alpha,beta-methylene Adenosine 5'-triphosphate (sodium salt) CAS 1343364-54-4
IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

英文名alpha,beta-methylene Adenosine 5′-triphosphate (sodium salt)
IUPAC Nametrisodium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[[[hydroxy(oxido)phosphoryl]oxy-oxidophosphoryl]methyl]phosphinate
分子结构Structure of alpha,beta-methylene Adenosine 5'-triphosphate (sodium salt) CAS 1343364-54-4
CAS编号 1343364-54-4
EINECS NumberNo data available
MDL NumberNo data available
Beilstein Registry NumberNo data available
别名trisodium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[[[hydroxy(oxido)phosphoryl]oxy-oxidophosphoryl]methyl]phosphinate
ALPHA,BETA-METHYLENEADENOSINE 5′-TRIPHOSPHATE TRISODIUM SALT; AKOS024457480; alpha,beta-Methyleneadenosine5′-TriphosphateTrisodiumSalt; Trisodium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[[[hydroxy(oxido)phosphoryl]oxy-oxidophosphoryl]methyl]phosphinate; trisodium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-[[[hydroxy(oxido)phosphoryl]oxy-oxido-phosphoryl]methyl]phosphinate; trisodium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-[[[hydroxy(oxido)phosphoryl]oxy-oxidophosphoryl]methyl]phosphinate; trisodium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-[[oxidanidyl-[oxidanidyl(oxidanyl)phosphoryl]oxy-phosphoryl]methyl]phosphinate; trisodium;[(2R,3S,4R,5R)-5-adenin-9-yl-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-[[[hydroxy(oxido)phosphoryl]oxy-oxido-phosphoryl]methyl]phosphinate
分子式C11H15N5Na3O12P3
分子量571.154
InChIInChI=1S/C11H18N5O12P3.3Na/c12-9-6-10(14-2-13-9)16(3-15-6)11-8(18)7(17)5(27-11)1-26-29(19,20)4-30(21,22)28-31(23,24)25;;;/h2-3,5,7-8,11,17-18H,1,4H2,(H,19,20)(H,21,22)(H2,12,13,14)(H2,23,24,25);;;/q;3*+1/p-3/t5-,7-,8-,11-;;;/m1…/s1
InChI KeyCBAGKCWFSRTVER-MTQUBGKESA-K
Canonical SMILESc1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(CP(=O)([O-])OP(=O)(O)[O-])[O-])O)O)N.[Na+].[Na+].[Na+]
Patent Information
No data available

Physical Data

AppearanceWhite powder
SolubilityNo data available
Flash PointNo data available
Refractive indexNo data available
SensitivityNo data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

GHS Hazard StatementsNot Classified
For more detailed information, please visit ECHA C&L website
Source: European Chemicals Agency (ECHA)
License Note: Use of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: “Source: European Chemicals Agency, http://echa.europa.eu/”. Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.
License URL: https://echa.europa.eu/web/guest/legal-notice
Record Name: (1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate
URL: https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/213446
Description: The information provided here is aggregated from the “Notified classification and labelling” from ECHA’s C&L Inventory. Read more: https://echa.europa.eu/information-on-chemicals/cl-inventory-database

Other Data

TransportationNONH for all modes of transport
Under the room temperature and away from light
HS CodeNo data available
StorageUnder the room temperature and away from light
Shelf Life1 year
Market PriceUSD
Use Pattern
alpha,beta-methylene Adenosine 5′-triphosphate (sodium salt) CAS#: 1343364-54-4 used as a nucleotide.

Cytidine 5′-(tetrahydrogen triphosphate), 5-Methyl- CAS#: 327174-86-7

By great_watson-int,
Structure of 5-Methylcytidine 5'-Triphosphate (CPT) Trisodium Salt CAS 327174-86-7
IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

英文名Cytidine 5′-(tetrahydrogen triphosphate), 5-Methyl-
IUPAC Name5-Methylcytidine 5′-Triphosphate (CPT) Trisodium Salt
分子结构Structure of 5-Methylcytidine 5'-Triphosphate (CPT) Trisodium Salt CAS 327174-86-7
CAS编号 327174-86-7
EINECS NumberNo data available
MDL NumberMFCD00131849
Beilstein Registry NumberNo data available
别名 2(1H)-Pyrimidinone, 4-amino-1-[(2ξ)-5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-β-D-threo-pentofuranosyl]-5-methyl- [ACD/Index Name]
4-Amino-1-[(2ξ)-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-threo-pentofuranosyl]-5-methyl-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-[(2ξ)-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-threo-pentofuranosyl]-5-methyl-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-[(2ξ)-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-thréo-pentofuranosyl]-5-méthyl-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
327174-86-7 [RN]
5-Methyl-CTP
5-Methylcytidine-5′-triphosphate sodium salt
分子式C10H18N3O14P3
分子量497.183
InChIYIJVOACVHQZMKI-WJZMDOFJSA-N
InChI KeyInChI=1S/C10H18N3O14P3/c1-4-2-13(10(16)12-8(4)11)9-7(15)6(14)5(25-9)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h2,5-7,9,14-15H,3H2,1H3,(H,20,21)(H,22,23)(H2,11,12,16)(H2,17,18,19)/t5-,6+,7?,9-/m1/s1
Canonical SMILESCc1cn(c(=O)nc1N)[C@H]2C([C@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)Oa+].[Na+].[Na+]
Patent Information
No data available

Physical Data

AppearanceWhite powder
SolubilityNo data available
Flash PointNo data available
Refractive indexNo data available
SensitivityNo data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

GHS Hazard StatementsNot Classified
For more detailed information, please visit ECHA C&L website
Source: European Chemicals Agency (ECHA)
License Note: Use of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: “Source: European Chemicals Agency, http://echa.europa.eu/”. Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.
License URL: https://echa.europa.eu/web/guest/legal-notice
Record Name: (1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate
URL: https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/213446
Description: The information provided here is aggregated from the “Notified classification and labelling” from ECHA’s C&L Inventory. Read more: https://echa.europa.eu/information-on-chemicals/cl-inventory-database

Other Data

TransportationNONH for all modes of transport
Under the room temperature and away from light
HS CodeNo data available
StorageUnder the room temperature and away from light
Shelf Life1 year
Market PriceUSD

Druglikeness

Lipinski rules component
分子量497.186
logP-6.128
HBA17
HBD7
Matching Lipinski Rules7
Veber rules component
Polar Surface Area (PSA)297.63
Rotatable Bond (RotB)8
Matching Veber Rules8
Use Pattern
Cytidine 5′-(tetrahydrogen triphosphate), 5-Methyl- CAS#: 327174-86-7 is a trisodium triphosphate salt of 5-Methylcytidine (M294850) a derivative of Cytidine (C998300).
Cytidine 5′-(tetrahydrogen triphosphate), 5-Methyl- CAS#: 327174-86-7 found in ribonucleic acids of animals, plants and bacteria.
Cytidine 5′-(tetrahydrogen triphosphate), 5-Methyl- CAS#: 327174-86-7 can inhibit the growth of spontaneous tumors of mammary gland origin in mice.
Cytidine 5′-(tetrahydrogen triphosphate), 5-Methyl- CAS#: 327174-86-7 is a nucleoside found in liver emulsion.

Guanosine 5′-triphosphate trisodium salt CAS#: 36051-31-7

By great_watson-int,
Structure of Guanosine-5'-triphosphate [GTP], Trisodium salt CAS 36051-31-7
IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

英文名Guanosine 5′-triphosphate trisodium salt
IUPAC Nametrisodium;[[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-oxidophosphoryl] phosphate
分子结构Structure of Guanosine-5'-triphosphate [GTP], Trisodium salt CAS 36051-31-7
CAS编号 36051-31-7
EINECS Number252-847-2
MDL NumberMFCD00077781
Beilstein Registry Number4113439
别名5′-O-(Hydroxy{[(phosphonatooxy)phosphinato]oxy}phosphoryl)guanosine de trisodium [French] [ACD/IUPAC Name]
GTP
Guanosine, 5′-(tetrahydrogen triphosphate), sodium salt (1:3) [ACD/Index Name]
Guanosine-5′-triphosphate sodium salt
MFCD00077781 [MDL number]
Trinatrium-5′-O-(hydroxy{[(phosphonatooxy)phosphinato]oxy}phosphoryl)guanosin [German] [ACD/IUPAC Name]
Trisodium 5′-O-(hydroxy{[(phosphonatooxy)phosphinato]oxy}phosphoryl)guanosine [ACD/IUPAC Name]
[36051-31-7]
2′-Deoxygunosine-5′-triphosphate trisodium salt
分子式C10H13N5Na3O14P3
分子量589.126
InChIInChI=1S/C10H16N5O14P3.3Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21;;;/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18);;;/q;3*+1/p-3/t3-,5-,6-,9-;;;/m1…/s1
InChI KeyKZRMTEVIDYXWQW-CYCLDIHTSA-K
Canonical SMILESc1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)([O-])OP(=O)([O-])[O-])O)O)[nH]c(nc2=O)N.[Na+].[Na+].[Na+]
Patent Information
No data available

Physical Data

AppearanceOff white powder
SolubilityNo data available
Flash PointNo data available
Refractive indexNo data available
SensitivityNo data available

Spectra

Description (NMR Spectroscopy)Nucleus (NMR Spectroscopy)Solvents (NMR Spectroscopy)Comment (NMR Spectroscopy)
Chemical shifts13CD2O
Spin-spin coupling constantsD2O31P-13C.

Route of Synthesis (ROS)

Route of Synthesis (ROS) of Guanosine 5'-triphosphate trisodium salt CAS 36051-31-7
Route of Synthesis (ROS) of Guanosine 5′-triphosphate trisodium salt CAS 36051-31-7
ConditionsYield
With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In water for 6h;58%

Safety and Hazards

GHS Hazard StatementsNot Classified
For more detailed information, please visit ECHA C&L website
Source: European Chemicals Agency (ECHA)
License Note: Use of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: “Source: European Chemicals Agency, http://echa.europa.eu/”. Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.
License URL: https://echa.europa.eu/web/guest/legal-notice
Record Name: (1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate
URL: https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/213446
Description: The information provided here is aggregated from the “Notified classification and labelling” from ECHA’s C&L Inventory. Read more: https://echa.europa.eu/information-on-chemicals/cl-inventory-database

Other Data

TransportationNONH for all modes of transport
Under the room temperature and away from light
HS CodeNo data available
StorageUnder the room temperature and away from light
Shelf Life1 year
Market PriceUSD
Druglikeness
Lipinski rules component
分子量589.129
logP-6.046
HBA19
HBD5
Matching Lipinski Rules2
Veber rules component
Polar Surface Area (PSA)332.73
Rotatable Bond (RotB)8
Matching Veber Rules1
Use Pattern
Guanosine 5′-triphosphate trisodium salt CAS#: 36051-31-7 is required as a coenzyme for protein biosynthesis in a cell-free system.
Guanosine 5′-triphosphate trisodium salt CAS#: 36051-31-7 has been used in FtsZ polymerization assay and in the preparation of pipette solution for the electrophysiological recordings of the whole-cell membrane currents.

Pseudouridine 5’-Triphosphate CAS#: 1175-34-4

By great_watson-int,
Structure of Uridine-5'-triphosphate Sodium Salt CAS 1175-34-4
IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

英文名Pseudouridine 5’-Triphosphate
IUPAC Name[[(2R,3S,4R,5S)-5-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
分子结构Structure of Uridine-5'-triphosphate Sodium Salt CAS 1175-34-4
CAS编号 1175-34-4
EINECS NumberNo data available
MDL NumberMFCD00131849
Beilstein Registry NumberNo data available
别名[[(2R,3S,4R,5S)-5-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Pseudouridine-5′-triphosphate; [[(2R,3S,4R,5S)-5-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate; SCHEMBL625518; ZINC77312680; Pseudouridine 5′-Triphosphate Triethylamine Salt; J-003632; W-200908; ((2R,3S,4R,5S)-5-(2,4-Dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate; [[(2R,3S,4R,5S)-5-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate; [[(2R,3S,4R,5S)-5-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate; [[(2R,3S,4R,5S)-5-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate; [[(2R,3S,4R,5S)-5-(2,4-diketo-1H-pyrimidin-5-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
分子式C9H15N2O15P3
分子量484.141
InChIInChI=1S/C9H15N2O15P3/c12-5-4(2-23-28(19,20)26-29(21,22)25-27(16,17)18)24-7(6(5)13)3-1-10-9(15)11-8(3)14/h1,4-7,12-13H,2H2,(H,19,20)(H,21,22)(H2,16,17,18)(H2,10,11,14,15)/t4-,5?,6?,7+/m1/s1
InChI KeyVEWJOCYCKIZKKV-BLOUUBGSSA-N
Canonical SMILESc1c(c(=O)[nH]c(=O)[nH]1)[C@H]2C(C([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O
Patent Information
No data available

Physical Data

AppearanceClear colorless solution
SolubilityNo data available
Flash PointNo data available
Refractive indexNo data available
SensitivityNo data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

GHS Hazard StatementsNot Classified
For more detailed information, please visit ECHA C&L website
Source: European Chemicals Agency (ECHA)
License Note: Use of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: “Source: European Chemicals Agency, http://echa.europa.eu/”. Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.
License URL: https://echa.europa.eu/web/guest/legal-notice
Record Name: (1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate
URL: https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/213446
Description: The information provided here is aggregated from the “Notified classification and labelling” from ECHA’s C&L Inventory. Read more: https://echa.europa.eu/information-on-chemicals/cl-inventory-database

Other Data

TransportationNONH for all modes of transport
Under the room temperature and away from light
HS CodeNo data available
StorageUnder the room temperature and away from light
Shelf Life1 year
Market PriceUSD
Use Pattern
Pseudouridine 5’-Triphosphate CAS#: 1175-34-4 used as a nucleotide.