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CHEBI:233856 - (5Z)-octenoyl-CoA(4−)

ChEBI IDCHEBI:233856
ChEBI Name(5Z)-octenoyl-CoA(4−)
Stars
ASCII Name(5Z)-octenoyl-CoA(4-)
Submitterlaimo
DownloadsMolfile
FormulaC29H44N7O17P3S
Net Charge-4
Average Mass887.692
Monoisotopic Mass887.17492
SMILESCC/C=C\CCCC(=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/C29H48N7O17P3S/c1-4-5-6-7-8-9-20(38)57-13-12-31-19(37)10-11-32-27(41)24(40)29(2,3)15-50-56(47,48)53-55(45,46)49-14-18-23(52-54(42,43)44)22(39)28(51-18)36-17-35-21-25(30)33-16-34-26(21)36/h5-6,16-18,22-24,28,39-40H,4,7-15H2,1-3H3,(H,31,37)(H,32,41)(H,45,46)(H,47,48)(H2,30,33,34)(H2,42,43,44)/p-4/b6-5-/t18-,22-,23-,24+,28-/m1/s1
InChIKeyHVXFSYIMAAXCIV-UTHBTJAGSA-J
ChEBI Ontology
Outgoing Relation(s)
(5Z)-octenoyl-CoA(4−) (CHEBI:233856) is a medium-chain 3-substituted propanoyl-CoA(4−) (CHEBI:83723)
(5Z)-octenoyl-CoA(4−) (CHEBI:233856) is a monounsaturated fatty acyl-CoA(4−) (CHEBI:77331)
Synonym  Source
CoA 8:1(5Z)(4−)SUBMITTER
UniProt Name  Source
(5Z)-octenoyl-CoAUniProt