Chemical Compound
3-Hydroxydecanoyl-coenzyme A
CAS Registry Number
79171-49-6
Primary Record
3-Hydroxydecanoyl-coenzyme A
- In stock
- 8,413 g
- Purity
- 99.6 %
- CAS
- 79171-49-6
Compound Identifiers & Properties
- CAS
- 79171-49-6
- PubChem CID
- 440605
- SMILES
- CCCCCCC[C@@H](CC(=O)SCCNC(=O)CCNC(=O)C(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
- CCCCCCC[C@H](O)CC(=O)SCCNC(=O)CCNC(=O)C(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
- 3-Hydroxydecanoyl-coenzyme A
- 3-Hydroxydecanoyl-coa
- Coenzyme A, 3-hydroxydecanoyl-
- (S)-Hydroxydecanoyl-CoA
- RefChem:911403
- AC1L99MC
- (S)-3-Hydroxydecanoyl-CoA
- C31H54N7O18P3S
- DTXSID201000322
- 3R-HYDROXYDECANOYL-COENZYME A
- CID440605
- Coenzyme A, S-(3-hydroxydecanoate), (S)-
- C31-H54-N7-O18-P3-S
- 79171-49-6
- J2.755.093B
- 3-Hydroxydecanoyl-CoA; (Acyl-CoA); [M+H]+;
- 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-hydroxydecanethioate
- {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[3-hydroxy-3-({2-[(2-{[(3S)-3-hydroxydecanoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
- 5'-O-[({[3,4-Dihydroxy-4-({3-hydroxy-3-[(2-{[(3S)-3-hydroxydecanoyl]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-[(3-hydroxydecanoyl)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 P2-[2,2-dimethyl-3-hydroxy-3-[[2-[[2-[[(S)-3-hydroxydecanoyl]thio]ethyl]aminocarbonyl]ethyl]aminocarbonyl]propyl]] ester