Chemical Compound

(R)-3-hydroxyoctanoyl-CoA

CAS Registry Number 117249-49-7
(R)-3-hydroxyoctanoyl-CoA chemical structure
Primary Record

(R)-3-hydroxyoctanoyl-CoA

In stock
6,116 g
Purity
98.5 %
CAS
117249-49-7

Compound Identifiers & Properties

CAS
117249-49-7
PubChem CID
11966193
SMILES
CCCCC[C@H](CC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(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)O)O
Canonical SMILES
CCCCC[C@@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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

Names & Synonyms

  • (R)-3-hydroxyoctanoyl-CoA
  • (R)-3-Hydroxycapryloyl-CoA
  • (R)-3-hydroxyoctanoyl CoA
  • (R)-3-hydroxyoctanoyl-coenzyme A
  • (R)-3-hydroxycapryloyl-coenzyme A
  • orb3022333
  • SCHEMBL3938475
  • CHEBI:28573
  • ATVGTMKWKDUCMS-JWBYWSJJSA-N
  • LMFA07050149
  • S-[(R)-3-Hydroxyoctanoyl]coenzyme A
  • CID11966193
  • J3.702.080J
  • C05266
  • C05278
  • 3-hydroxyoctanoyl-CoA; (Acyl-CoA); [M+H]+;
  • Q27103779
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxyoctanoyl]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] (3R)-3-hydroxyoctanethioate
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-({2-[(2-{[(3R)-3-hydroxyoctanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
  • 117249-49-7