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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H14N5O13P3.2Na.3H2O
Molecular Weight 605.1905
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADENOSINE TRIPHOSPHATE DISODIUM TRIHYDRATE

SMILES

O.O.O.[Na+].[Na+].NC1=NC=NC2=C1N=CN2[C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP([O-])([O-])=O)[C@@H](O)[C@H]3O

InChI

InChIKey=MWEQTWJABOLLOS-AZGWGOJFSA-L
InChI=1S/C10H16N5O13P3.2Na.3H2O/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20;;;;;/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20);;;3*1H2/q;2*+1;;;/p-2/t4-,6-,7-,10-;;;;;/m1...../s1

HIDE SMILES / InChI

Molecular Formula C10H14N5O13P3
Molecular Weight 505.1651
Charge -2
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:35:15 UTC 2023
Edited
by admin
on Sat Dec 16 01:35:15 UTC 2023
Record UNII
7ZRM409FOZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ADENOSINE TRIPHOSPHATE DISODIUM TRIHYDRATE
Common Name English
ADENOSINE TRIPHOSPHATE DISODIUM HYDRATE [JAN]
Common Name English
ADENOSINE 5'-(TETRAHYDROGEN TRIPHOSPHATE), DISODIUM SALT, TRIHYDRATE
Common Name English
ATP DISODIUM HYDRATE
Common Name English
Adenosine triphosphate disodium trihydrate [WHO-DD]
Common Name English
ATP DISODIUM TRIHYDRATE
Common Name English
DISODIUM ADENOSINE 5'-TRIPHOSPHATE TRIHYDRATE
Common Name English
ADENOSINE TRIPHOSPHATE DISODIUM HYDRATE
JAN  
Common Name English
Code System Code Type Description
EVMPD
SUB33473
Created by admin on Sat Dec 16 01:35:15 UTC 2023 , Edited by admin on Sat Dec 16 01:35:15 UTC 2023
PRIMARY
SMS_ID
100000127450
Created by admin on Sat Dec 16 01:35:15 UTC 2023 , Edited by admin on Sat Dec 16 01:35:15 UTC 2023
PRIMARY
FDA UNII
7ZRM409FOZ
Created by admin on Sat Dec 16 01:35:15 UTC 2023 , Edited by admin on Sat Dec 16 01:35:15 UTC 2023
PRIMARY
PUBCHEM
5282498
Created by admin on Sat Dec 16 01:35:15 UTC 2023 , Edited by admin on Sat Dec 16 01:35:15 UTC 2023
PRIMARY
DRUG BANK
DBSALT002407
Created by admin on Sat Dec 16 01:35:15 UTC 2023 , Edited by admin on Sat Dec 16 01:35:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID40966292
Created by admin on Sat Dec 16 01:35:15 UTC 2023 , Edited by admin on Sat Dec 16 01:35:15 UTC 2023
PRIMARY
CAS
51963-61-2
Created by admin on Sat Dec 16 01:35:15 UTC 2023 , Edited by admin on Sat Dec 16 01:35:15 UTC 2023
PRIMARY
Related Record Type Details
ANHYDROUS->SOLVATE
Related Record Type Details
ACTIVE MOIETY