EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:233854 - (3S,7Z)-3-hydroxydecenoyl-CoA(4−)

ChEBI IDCHEBI:233854
ChEBI Name(3S,7Z)-3-hydroxydecenoyl-CoA(4−)
Stars
ASCII Name(3S,7Z)-3-hydroxydecenoyl-CoA(4-)
Submitterlaimo
DownloadsMolfile
FormulaC31H48N7O18P3S
Net Charge-4
Average Mass931.745
Monoisotopic Mass931.20113
SMILESCC/C=C\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-]
InChIInChI=1S/C31H52N7O18P3S/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/h5-6,17-20,24-26,30,39,42-43H,4,7-16H2,1-3H3,(H,33,40)(H,34,44)(H,48,49)(H,50,51)(H2,32,35,36)(H2,45,46,47)/p-4/b6-5-/t19-,20+,24+,25+,26-,30+/m0/s1
InChIKeyAVANPBPOZZHOAU-DVZLJLELSA-J
ChEBI Ontology
Outgoing Relation(s)
(3S,7Z)-3-hydroxydecenoyl-CoA(4−) (CHEBI:233854) is a medium-chain (3S)-hydroxy fatty acyl-CoA(4−) (CHEBI:191200)
Synonym  Source
CoA 3S-OH-10:1(7Z)(4−)SUBMITTER
UniProt Name  Source
(3S)-hydroxy-(7Z)-decenoyl-CoAUniProt