Chemical Compound

3-hydroxyadipyl-CoA

CAS Registry Number 25157-96-4
3-hydroxyadipyl-CoA chemical structure
Primary Record

3-hydroxyadipyl-CoA

In stock
2,839 g
Purity
98.4 %
CAS
25157-96-4

Compound Identifiers & Properties

CAS
25157-96-4
PubChem CID
9543337
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)CC(CCC(=O)O)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)CC(O)CCC(=O)O

Names & Synonyms

  • 3-hydroxyadipyl-CoA
  • 3-hydroxyadipoyl-CoA
  • 3-hydroxyadipoyl-coenzyme A
  • 3-Hydroxypentanoyl-CoA
  • S-(5-carboxy-3-hydroxypentanoyl)-CoA
  • SCHEMBL217525
  • orb3022340
  • SCHEMBL29399606
  • CHEBI:71038
  • DTXSID701343646
  • S-(5-carboxy-3-hydroxypentanoyl)-coenzyme A
  • LMFA07050211
  • CID9543337
  • C14145
  • CID9543337; (Acyl-CoA); [M+H]+;
  • Q27139268
  • 3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-[(5-carboxy-3-hydroxypentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • 25157-96-4
  • 6-((2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl)thio)-4-hydroxy-6-oxohexanoic acid
  • 6-[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]ethylsulfanyl]-4-hydroxy-6-oxohexanoic acid