U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H17N5O16P4
Molecular Weight 587.1609
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADENOSINE 5'-TETRAPHOSPHATE

SMILES

NC1=C2N=CN([C@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)C2=NC=N1

InChI

InChIKey=WWMWAMFHUSTZTA-VTHZCTBJSA-N
InChI=1S/C10H17N5O16P4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(28-10)1-27-33(21,22)30-35(25,26)31-34(23,24)29-32(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H,25,26)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10?/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H17N5O16P4
Molecular Weight 587.1609
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:00:08 GMT 2023
Edited
by admin
on Sat Dec 16 08:00:08 GMT 2023
Record UNII
DBK98M4ZT7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ADENOSINE 5'-TETRAPHOSPHATE
Common Name English
ATETRAP
Common Name English
(((((((((2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYOXOLAN-2-YL)METHOXY)(HYDROXY)PHOSPHORYL)OXY)(HYDROXY)PHOSPHORYL)OXY)(HYDROXY)PHOSPHORYL)OXY)PHOSPHONIC ACID
Systematic Name English
ADENOSINE 5'-(PENTAHYDROGEN TETRAPHOSPHATE)
Systematic Name English
ADENOSINE TETRAPHOSPHATE
Common Name English
Code System Code Type Description
CHEBI
18334
Created by admin on Sat Dec 16 08:00:08 GMT 2023 , Edited by admin on Sat Dec 16 08:00:08 GMT 2023
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FDA UNII
DBK98M4ZT7
Created by admin on Sat Dec 16 08:00:08 GMT 2023 , Edited by admin on Sat Dec 16 08:00:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID901261206
Created by admin on Sat Dec 16 08:00:08 GMT 2023 , Edited by admin on Sat Dec 16 08:00:08 GMT 2023
PRIMARY
CAS
1062-98-2
Created by admin on Sat Dec 16 08:00:08 GMT 2023 , Edited by admin on Sat Dec 16 08:00:08 GMT 2023
PRIMARY
PUBCHEM
165411871
Created by admin on Sat Dec 16 08:00:08 GMT 2023 , Edited by admin on Sat Dec 16 08:00:08 GMT 2023
PRIMARY
WIKIPEDIA
Adenosine 5'-tetraphosphate
Created by admin on Sat Dec 16 08:00:08 GMT 2023 , Edited by admin on Sat Dec 16 08:00:08 GMT 2023
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