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CHEBI:209006 - Microporenic acid A

ChEBI IDCHEBI:209006
ChEBI NameMicroporenic acid A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H40O7
Net Charge0
Average Mass464.599
Monoisotopic Mass464.27740
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CO[C@@H](C(=O)O)[C@H](CC(=O)O)C(=O)O
InChIInChI=1S/C26H40O7/c1-18(2)9-6-10-19(3)11-7-12-20(4)13-8-14-21(5)15-16-33-24(26(31)32)22(25(29)30)17-23(27)28/h9,11,13,15,22,24H,6-8,10,12,14,16-17H2,1-5H3,(H,27,28)(H,29,30)(H,31,32)/b19-11+,20-13+,21-15+/t22-,24+/m0/s1
InChIKeyARIRKWOGKXMXSQ-RNEKESDJSA-N
Species of MetaboliteComponentSourceComments
Microporusspecies (in: basidiomycete fungi) (ncbitaxon:2007320) - PubMed (29489350)
ChEBI Ontology
Outgoing Relation(s)
Microporenic acid A (CHEBI:209006) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1R,2S)-1-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenoxy]propane-1,2,3-tricarboxylic acid
Manual XrefsDatabases
78439044ChemSpider