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CHEBI:209032 - Microporenic acid E

ChEBI IDCHEBI:209032
ChEBI NameMicroporenic acid E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H32O7
Net Charge0
Average Mass396.480
Monoisotopic Mass396.21480
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CO[C@@H](C(=O)O)[C@H](CC(=O)O)C(=O)O
InChIInChI=1S/C21H32O7/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-28-19(21(26)27)17(20(24)25)13-18(22)23/h7,9,11,17,19H,5-6,8,10,12-13H2,1-4H3,(H,22,23)(H,24,25)(H,26,27)/b15-9+,16-11+/t17-,19+/m0/s1
InChIKeyWNCOHPCRBBRDAX-KSTWPOFPSA-N
Species of MetaboliteComponentSourceComments
Microporusspecies (in: basidiomycete fungi) (ncbitaxon:2007320) - PubMed (29489350)
ChEBI Ontology
Outgoing Relation(s)
Microporenic acid E (CHEBI:209032) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,2S)-1-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]propane-1,2,3-tricarboxylic acid
Manual XrefsDatabases
78439048ChemSpider