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CHEBI:207712 - 10,11-dihydrobisvertinolone

ChEBI IDCHEBI:207712
ChEBI Name10,11-dihydrobisvertinolone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H34O9
Net Charge0
Average Mass514.571
Monoisotopic Mass514.22028
SMILESC/C=C/C=C/C(O)=C1\C(=O)[C@](C)(O)[C@]2(O)O[C@]3(C)C(O)=C(C)C(O)=C(C(=O)CC/C=C/C)[C@@H]3[C@]2(C)C1=O
InChIInChI=1S/C28H34O9/c1-7-9-11-13-16(29)18-20(31)15(3)22(32)26(5)21(18)25(4)23(33)19(17(30)14-12-10-8-2)24(34)27(6,35)28(25,36)37-26/h7-10,12,14,21,30-32,35-36H,11,13H2,1-6H3/b9-7+,10-8+,14-12+,19-17+/t21-,25-,26+,27+,28-/m1/s1
InChIKeyOISFXXNCDWRAFG-NATBERAISA-N
Species of MetaboliteComponentSourceComments
Trichodermaspecies (ncbitaxon:1715253) - PubMed (19182418)
ChEBI Ontology
Outgoing Relation(s)
10,11-dihydrobisvertinolone (CHEBI:207712) is a secondary α-hydroxy ketone (CHEBI:2468)
IUPAC Name 
(2E,4S,4aR,5aS,9aR,9bR)-9-[(E)-hex-4-enoyl]-4,4a,6,8-tetrahydroxy-2-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-4,5a,7,9b-tetramethyl-9aH-dibenzouran-1,3-dione
Manual XrefsDatabases
78438431ChemSpider