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CHEBI:198299 - Cubensic acid

ChEBI IDCHEBI:198299
ChEBI NameCubensic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H52O7
Net Charge0
Average Mass524.739
Monoisotopic Mass524.37130
SMILESCCC(C)CC(/C=C(\C)C(O)C(C)/C=C/C(O)C(C)/C=C/C(O)C(C)/C=C(\C)C(O)C(C)C(=O)O)CO
InChIInChI=1S/C30H52O7/c1-9-18(2)14-25(17-31)16-23(7)28(34)20(4)11-13-26(32)19(3)10-12-27(33)21(5)15-22(6)29(35)24(8)30(36)37/h10-13,15-16,18-21,24-29,31-35H,9,14,17H2,1-8H3,(H,36,37)/b12-10+,13-11+,22-15+,23-16+
InChIKeyUHSVRGKIDHLSHC-DGGMLRAJSA-N
Species of MetaboliteComponentSourceComments
Lasiodiplodiaspecies (ncbitaxon:1891967) - DOI (10.1039/p19910001411)
ChEBI Ontology
Outgoing Relation(s)
Cubensic acid (CHEBI:198299) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(4E,8E,12E,16E)-3,7,11,15-tetrahydroxy-18-(hydroxymethyl)-2,4,6,10,14,16,20-heptamethyldocosa-4,8,12,16-tetraenoic acid
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9780890ChemSpider