Chemical Compound

(S)-3-Hydroxyhexanoyl-CoA

CAS Registry Number 79171-47-4
(S)-3-Hydroxyhexanoyl-CoA chemical structure
Primary Record

(S)-3-Hydroxyhexanoyl-CoA

In stock
3,916 g
Purity
99.0 %
CAS
79171-47-4

Compound Identifiers & Properties

CAS
79171-47-4
PubChem CID
11966160
SMILES
CCC[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
CCC[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

  • (S)-3-Hydroxyhexanoyl-CoA
  • (S)-Hydroxyhexanoyl-CoA
  • (S)-3-hydroxycaproyl-CoA
  • [R,S]-Lactyl CoA
  • S-(3-hydroxyhexanoate
  • 3-hydroxyhexanoyl-coenzyme A
  • 3S-hydroxyhexanoyl-CoA
  • (S)-3-hydroxycaproyl-coenzyme A
  • RefChem:1051165
  • S-(3-hydroxyhexanoic acid
  • S-(3-hydroxyhexanoate)CoA
  • [R,S]-Lactyl Coenzyme A
  • CHEBI:28276
  • SCHEMBL29934863
  • S-(3-hydroxyhexanoate)Coenzyme A
  • 1-(3,4-dichlorophenyl)ethanamine
  • DTXSID101280137
  • (S)-3-Hydroxyhexanoyl-Coenzyme A
  • 1-(4-fluorophenyl)propan-1-amine
  • LMFA07050156
  • CID11966160
  • C05268
  • Coenzyme A, S-[(3S)-3-hydroxyhexanoate]
  • 79171-47-4
  • 3-hydroxyhexanoyl-coenzyme A; (Acyl-CoA); [M+H]+;
  • Q27103605
  • 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] (3S)-3-hydroxyhexanethioate
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3S)-3-hydroxyhexanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
  • 3'-phosphoadenosine 5'-(3-((3R)-3-hydroxy-4-((3-((2-(((3S)-3-hydroxyhexanoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-2,2-dimethyl-4-oxobutyl) dihydrogen diphosphate)
  • 3H9
  • 74875-70-0
  • 74877-07-9
  • 74877-10-4
  • 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) (3S)-3-hydroxyhexanethioate
  • S-[2-[3-[[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] (3S)-3-hydroxyhexanethioate
  • S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} (3S)-3-hydroxyhexanethioate