Chemical Compound
4-hydroxybenzoyl-CoA
CAS Registry Number
27718-41-8
Primary Record
4-hydroxybenzoyl-CoA
- In stock
- 1,032 g
- Purity
- 99.5 %
- CAS
- 27718-41-8
Compound Identifiers & Properties
- CAS
- 27718-41-8
- PubChem CID
- 168718
- SMILES
- CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSC(=O)C4=CC=C(C=C4)O)O
- Canonical SMILES
- CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)c1ccc(O)cc1
Names & Synonyms
- 4-hydroxybenzoyl-CoA
- 4-Hydroxybenzoyl-coenzyme A
- p-hydroxybenzoyl-CoA
- p-hydroxybenzoyl-coenzyme A
- p-Hydroxybenzoyl CoA
- 4-Hydroxybenoyl-CoA
- 4-hydroxybenzoyl CoA
- 4-HYDROXYBENZOYL COENZYME A
- Coenzyme A, 4-hydroxybenzoyl-
- RefChem:99280
- S-(4-hydroxybenzoyl)-CoA
- Coenzyme A, S-(4-hydroxybenzoate)
- AC1L52EV
- CHEBI:15500
- SCHEMBL455122
- SCHEMBL455123
- orb3022198
- S-(4-Hydroxybenzoyl)coenzyme A
- SCHEMBL29941279
- CTK4G0170
- DTXSID00950415
- Coenzyme A,S-(4-hydroxybenzoate)
- AR-1L3760
- c0124
- CID168718
- 27718-41-8
- DB01652
- PD008886
- J704.621I
- NS00073103
- 4-hydroxybenzoyl-CoA; (Acyl-CoA); [M+H]+;
- C02949
- Q27089482
- BCA
- 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybenzoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
- S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-hydroxybenzenecarbothioate
- {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-[(2-{[2-(4-hydroxybenzoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
- 3'-phosphoadenosine 5'-(3-((3R)-3-hydroxy-4-((3-((2-((4-hydroxybenzoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate)
- 33360-21-3
- 5'-O-[({[(3R)-3,4-Dihydroxy-4-{[3-hydroxy-3-({2-[(4-hydroxybenzoyl)sulfanyl]ethyl}imino)propyl]imino}-2,2-dimethylbutoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate)
- 9-{5-O-[{[(3,4-Dihydroxy-4-{[3-hydroxy-3-({2-[(4-hydroxybenzoyl)sulfanyl]ethyl}imino)propyl]imino}-2,2-dimethylbutoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-3-O-phosphonopentofuranosyl}-9H-purin-6-amine
- Adenosine 3 -phosphoric acid 5 -[diphosphoric acid beta-[(R)-3-hydroxy-2,2-dimethyl-4-[[3-[[2-(4-hydroxybenzoylthio)ethyl]amino]-3-oxopropyl]amino]-4-oxobutyl]] ester
- s-{(9r)-1-[(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3|E5,5|E5-diphosphaheptadecan-17-yl} 4-hydroxybenzenecarbothioate(non-preferred name)
- S-{(9R,13S,15S)-17-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-9,13,15-trihydroxy-10,10-dimethyl-13,15-dioxido-4,8-dioxo-12,14,16-trioxa-3,7-diaza-13,15-diphosphaheptadec-1-yl} 4-hydroxybenzenecarbothioate (non-preferred name)