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CHEBI:210826 - Fiscpropionate D

ChEBI IDCHEBI:210826
ChEBI NameFiscpropionate D
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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-DINPGYPASA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31799843)
ChEBI Ontology
Outgoing Relation(s)
Fiscpropionate D (CHEBI:210826) is a diterpenoid (CHEBI:23849)
IUPAC Name 
3-hydroxy-1-[(2E,4E,6E,8E,10R,12S,14S,16S)-12-(hydroxymethyl)-6,8,10,14,16-pentamethyloctadeca-2,4,6,8-tetraenoyl]piperidin-2-one
Manual XrefsDatabases
81360805ChemSpider