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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H17N6O8P
Molecular Weight 452.3153
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NIACINAMIDE ADENYLATE

SMILES

OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)N2C=NC3=C2N=CN=C3NC(=O)C4=CN=CC=C4

InChI

InChIKey=ZAAJIZNPDZSLRX-UBEDBUPSSA-N
InChI=1S/C16H17N6O8P/c23-5-9-12(30-31(26,27)28)11(24)16(29-9)22-7-20-10-13(18-6-19-14(10)22)21-15(25)8-2-1-3-17-4-8/h1-4,6-7,9,11-12,16,23-24H,5H2,(H2,26,27,28)(H,18,19,21,25)/t9-,11-,12-,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H17N6O8P
Molecular Weight 452.3153
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 Fri Dec 15 15:09:17 GMT 2023
Edited
by admin
on Fri Dec 15 15:09:17 GMT 2023
Record UNII
A96HRS08UR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NIACINAMIDE ADENYLATE
Common Name English
(2R,3S,4R,5R)-4-HYDROXY-2-(HYDROXYMETHYL)-5-(6-(NICOTINAMIDO)-9H-PURIN-9-YL)TETRAHYDROFURAN-3-YL DIHYDROGEN PHOSPHATE
Systematic Name English
NICOTINAMIDE ADENYLATE
Common Name English
Code System Code Type Description
FDA UNII
A96HRS08UR
Created by admin on Fri Dec 15 15:09:17 GMT 2023 , Edited by admin on Fri Dec 15 15:09:17 GMT 2023
PRIMARY
PUBCHEM
14847
Created by admin on Fri Dec 15 15:09:17 GMT 2023 , Edited by admin on Fri Dec 15 15:09:17 GMT 2023
PRIMARY
CAS
958779-80-1
Created by admin on Fri Dec 15 15:09:17 GMT 2023 , Edited by admin on Fri Dec 15 15:09:17 GMT 2023
PRIMARY