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CHEBI:228022 - Monascuspirolide B

ChEBI IDCHEBI:228022
ChEBI NameMonascuspirolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O6
Net Charge0
Average Mass360.406
Monoisotopic Mass360.15729
SMILESCC1CC(=O)CC2(O1)OC(C)Cc1cc3c(cc12)C(=O)[C@](C)(O)[C@H](O)C3
InChIInChI=1S/C20H24O6/c1-10-4-13-6-12-7-17(22)19(3,24)18(23)15(12)8-16(13)20(25-10)9-14(21)5-11(2)26-20/h6,8,10-11,17,22,24H,4-5,7,9H2,1-3H3/t10?,11?,17-,19-,20?/m1/s1
InChIKeyXTKADYALXVCBGX-NLHKBIBISA-N
Species of MetaboliteComponentSourceComments
Monascus (ncbitaxon:5097) - DOI (10.1016/j.phytol.2018.12.017)
ChEBI Ontology
Outgoing Relation(s)
Monascuspirolide B (CHEBI:228022) is a organic heterotricyclic compound (CHEBI:26979)
Monascuspirolide B (CHEBI:228022) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(7R,8R)-7,8-dihydroxy-3,6',8-trimethylspiro[3,4,6,7-tetrahydrobenzo[g]isochromene-1,2'-oxane]-4',9-dione