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CHEBI:210820 - Fiscpropionate C

ChEBI IDCHEBI:210820
ChEBI NameFiscpropionate C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H40O6
Net Charge0
Average Mass448.600
Monoisotopic Mass448.28249
SMILESCC[C@H](COC(C)=O)C[C@H](C)C[C@H](C)C[C@@H](C)/C=C(C)/C=C(/C=C/C=C/C(=O)O)C(=O)O
InChIInChI=1S/C26H40O6/c1-7-23(17-32-22(6)27)15-20(4)13-18(2)12-19(3)14-21(5)16-24(26(30)31)10-8-9-11-25(28)29/h8-11,14,16,18-20,23H,7,12-13,15,17H2,1-6H3,(H,28,29)(H,30,31)/b10-8+,11-9+,21-14+,24-16-/t18-,19-,20-,23+/m1/s1
InChIKeyZYGNASYDERYKGT-RQUKOVBASA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31799843)
ChEBI Ontology
Outgoing Relation(s)
Fiscpropionate C (CHEBI:210820) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(2E,4E,6Z)-6-[(E,4R,6S,8R,10S)-10-(acetyloxymethyl)-2,4,6,8-tetramethyldodec-2-enylidene]hepta-2,4-dienedioic acid
Manual XrefsDatabases
81360804ChemSpider