Chemical Compound

Benzamide adenine nucleotide

CAS Registry Number 156724-91-3

Primary Record

Compound Identifiers & Properties

CAS: 156724-91-3
PubChem CID: 158378
SMILES: C1=CC(=CC(=C1)C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O
Canonical SMILES: NC(=O)c1cccc([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1

Benzamide adenine nucleotide
benzamideadeninedinucleoside
Benzamide Adenine Dinucleotide
AC1L4JTK
RefChem:916848
DTXSID40166119
CHEMBL233434
orb2646168
156724-91-3
DTXCID6088610
SCHEMBL29782910
HNKKJJHKTPALEK-RACQCECLSA-N
BDBM50203628
CID158378
CID:158378
C22-H28-N6-O14-P2
SID:254561553
J574.126B
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
C100366
3-[5-O-(5 -Adenylyloxyphosphonyl)-beta-D-ribofuranosyl]benzamide
[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name)
3-[5-O-[(5 -Adenylyloxy)phosphonyl]-beta-D-ribofuranosyl]benzamide
Adenosine 5'-(trihydrogen diphosphate), P'-5'-ester with 3-beta-D-ribofuranosylbenzamide
[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen diphosphate
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[(2R,3S,4R,5S)-5-(3-carbamoylphenyl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphinic acid
Adenosine 5 -diphosphoric acid P2-[1-(3-carbamoylphenyl)-1,5-dideoxy-beta-D-ribofuranose-5-yl] ester
BAD
Diphosphoric acid alpha-(5 -adenosyl)beta-[[[(2R)-5alpha-(3-carbamoylphenyl)tetrahydro-3beta,4beta-dihydroxyfuran]-2alpha-yl]methyl] ester
DQV