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CHEBI:208305 - 3alpha,6beta-dihydroxycinnamolide

ChEBI IDCHEBI:208305
ChEBI Name3alpha,6beta-dihydroxycinnamolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESCC1(C)[C@H](O)CC[C@]2(C)[C@H]3COC(=O)C3=C[C@@H](O)[C@@H]12
InChIInChI=1S/C15H22O4/c1-14(2)11(17)4-5-15(3)9-7-19-13(18)8(9)6-10(16)12(14)15/h6,9-12,16-17H,4-5,7H2,1-3H3/t9-,10+,11+,12-,15+/m0/s1
InChIKeyHITOUNKZPBQZSA-MVIRXUPPSA-N
Species of MetaboliteComponentSourceComments
Inonotus rickii (ncbitaxon:184120) - PubMed (24974836)
ChEBI Ontology
Outgoing Relation(s)
3alpha,6beta-dihydroxycinnamolide (CHEBI:208305) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(5R,5aR,7R,9aR,9bR)-5,7-dihydroxy-6,6,9a-trimethyl-5,5a,7,8,9,9b-hexahydro-1H-benzo[e][2]benzouran-3-one
Manual XrefsDatabases
78441288ChemSpider