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CHEBI:74272 - (R)-3-hydroxydecanoyl-CoA(4−)

ChEBI IDCHEBI:74272
ChEBI Name(R)-3-hydroxydecanoyl-CoA(4−)
Stars
ASCII Name(R)-3-hydroxydecanoyl-CoA(4-)
DefinitionA 3-hydroxy fatty acyl-CoA(4−) obtained by deprotonation of the phosphate and diphosphate OH groups of (R)-3-hydroxydecanoyl-CoA.
Last Modified5 October 2020
SubmitterHnin
DownloadsMolfile
FormulaC31H50N7O18P3S
Net Charge-4
Average Mass933.761
Monoisotopic Mass933.21678
SMILESCCCCCCC[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-]
InChIInChI=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)/p-4/t19-,20-,24-,25-,26+,30-/m1/s1
InChIKeyHIVSMYZAMUNFKZ-PDQACDDGSA-J
ChEBI Ontology
Outgoing Relation(s)
(R)-3-hydroxydecanoyl-CoA(4−) (CHEBI:74272) is a (R)-3-hydroxyacyl-CoA(4−) (CHEBI:57319)
(R)-3-hydroxydecanoyl-CoA(4−) (CHEBI:74272) is a 3-hydroxydecanoyl-CoA(4−) (CHEBI:86041)
(R)-3-hydroxydecanoyl-CoA(4−) (CHEBI:74272) is conjugate base of (R)-3-hydroxydecanoyl-CoA (CHEBI:74405)
Incoming Relation(s)
(R)-3-hydroxydecanoyl-CoA (CHEBI:74405) is conjugate acid of (R)-3-hydroxydecanoyl-CoA(4−) (CHEBI:74272)
IUPAC Name 
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxydecanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
Synonyms  Source
(R)-3-hydroxydecanoyl-CoASUBMITTER
(R)-3-hydroxydecanoyl-coenzyme A(4−)ChEBI
UniProt Name  Source
(3R)-3-hydroxydecanoyl-CoAUniProt
Manual XrefsDatabases
CPD-12777MetaCyc