CHEBI:74405 - (R)-3-hydroxydecanoyl-CoA

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ChEBI Name (R)-3-hydroxydecanoyl-CoA
ChEBI ID CHEBI:74405
ChEBI ASCII Name (R)-3-hydroxydecanoyl-CoA
Definition A 3-hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (R)-3-hydroxydecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C31H54N7O18P3S
Net Charge 0
Average Mass 937.78300
Monoisotopic Mass 937.24589
InChI InChI=1S/C31H54N7O18P3S/c1-4-5-6-7-8-9-19(39)14-22(41)60-13-12-33-21(40)10-11-34-29(44)26(43)31(2,3)16-53-59(50,51)56-58(48,49)52-15-20-25(55-57(45,46)47)24(42)30(54-20)38-18-37-23-27(32)35-17-36-28(23)38/h17-20,24-26,30,39,42-43H,4-16H2,1-3H3,(H,33,40)(H,34,44)(H,48,49)(H,50,51)(H2,32,35,36)(H2,45,46,47)/t19-,20-,24-,25-,26+,30-/m1/s1
InChIKey HIVSMYZAMUNFKZ-PDQACDDGSA-N
SMILES CCCCCCC[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]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-3-hydroxydecanoyl-CoA (CHEBI:74405) has functional parent decanoic acid (CHEBI:30813)
(R)-3-hydroxydecanoyl-CoA (CHEBI:74405) is a (R)-3-hydroxyacyl-CoA (CHEBI:15456)
(R)-3-hydroxydecanoyl-CoA (CHEBI:74405) is a 3-hydroxydecanoyl-CoA (CHEBI:86338)
(R)-3-hydroxydecanoyl-CoA (CHEBI:74405) is conjugate acid of (R)-3-hydroxydecanoyl-CoA(4−) (CHEBI:74272)
Incoming (R)-3-hydroxydecanoyl-CoA(4−) (CHEBI:74272) is conjugate base of (R)-3-hydroxydecanoyl-CoA (CHEBI:74405)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonym Source
(R)-3-hydroxydecanoyl-coenzyme A ChEBI
Manual Xref Database
CPD-12777 MetaCyc
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Last Modified
06 July 2015