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CHEBI:225591 - Xylodonin B

ChEBI IDCHEBI:225591
ChEBI NameXylodonin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H30O4
Net Charge0
Average Mass382.500
Monoisotopic Mass382.21441
SMILESCC1(C)CCC[C@]2(C)[C@@H]3C(=C[C@H](OC(=O)/C=C/c4ccccc4)[C@@H]12)CO[C@H]3O
InChIInChI=1S/C24H30O4/c1-23(2)12-7-13-24(3)20-17(15-27-22(20)26)14-18(21(23)24)28-19(25)11-10-16-8-5-4-6-9-16/h4-6,8-11,14,18,20-22,26H,7,12-13,15H2,1-3H3/b11-10+/t18-,20+,21-,22+,24+/m0/s1
InChIKeyJVIVBUUWKBUORJ-FFZDIWAZSA-N
Species of MetaboliteComponentSourceComments
Xylodon flaviporus (ncbitaxon:2173181) - PubMed (31599157)
ChEBI Ontology
Outgoing Relation(s)
Xylodonin B (CHEBI:225591) is a naphthofuran (CHEBI:39270)
IUPAC Name 
[(1R,5S,5aS,9aS,9bR)-1-hydroxy-6,6,9a-trimethyl-1,3,5,5a,7,8,9,9b-octahydrobenzo[e][2]benzouran-5-yl] (E)-3-phenylprop-2-enoate