EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:233855 - 3-oxo-(7Z)-decenoyl-CoA(4−)

ChEBI IDCHEBI:233855
ChEBI Name3-oxo-(7Z)-decenoyl-CoA(4−)
Stars
ASCII Name3-oxo-(7Z)-decenoyl-CoA(4-)
Submitterlaimo
DownloadsMolfile
FormulaC31H46N7O18P3S
Net Charge-4
Average Mass929.729
Monoisotopic Mass929.18548
SMILESCC/C=C\CCCC(=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/C31H50N7O18P3S/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/h5-6,17-18,20,24-26,30,42-43H,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-/t20-,24-,25-,26+,30-/m1/s1
InChIKeyCAOIKCCYWOADLF-QNRDQHSLSA-J
ChEBI Ontology
Outgoing Relation(s)
3-oxo-(7Z)-decenoyl-CoA(4−) (CHEBI:233855) is a medium-chain 3-oxoacyl-CoA(4−) (CHEBI:229604)
3-oxo-(7Z)-decenoyl-CoA(4−) (CHEBI:233855) is a monounsaturated fatty acyl-CoA(4−) (CHEBI:77331)
Synonyms  Source
CoA 3-oxo-10:1(7Z)(4−)SUBMITTER
3-keto-(7Z)-decenoyl-CoA(4−)SUBMITTER
UniProt Name  Source
3-oxo-(7Z)-decenoyl-CoAUniProt