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CHEBI:210832 - Fiscpropionate E

ChEBI IDCHEBI:210832
ChEBI NameFiscpropionate E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H47NO4
Net Charge0
Average Mass473.698
Monoisotopic Mass473.35051
SMILESCC[C@H](C)C[C@H](C)C[C@H](CO)C[C@@H](C)/C=C(C)/C=C(C)\C=C\C=C\C(=O)N1CCCC(O)C1=O
InChIInChI=1S/C29H47NO4/c1-7-21(2)15-24(5)18-26(20-31)19-25(6)17-23(4)16-22(3)11-8-9-13-28(33)30-14-10-12-27(32)29(30)34/h8-9,11,13,16-17,21,24-27,31-32H,7,10,12,14-15,18-20H2,1-6H3/b11-8+,13-9+,22-16-,23-17+/t21-,24-,25-,26-,27?/m0/s1
InChIKeyILIRNOFAKGDUJL-YXQKTYAOSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31799843)
ChEBI Ontology
Outgoing Relation(s)
Fiscpropionate E (CHEBI:210832) is a diterpenoid (CHEBI:23849)
IUPAC Name 
3-hydroxy-1-[(2E,4E,6Z,8E,10R,12S,14S,16S)-12-(hydroxymethyl)-6,8,10,14,16-pentamethyloctadeca-2,4,6,8-tetraenoyl]piperidin-2-one
Manual XrefsDatabases
81360806ChemSpider