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CHEBI:214155 - Versixanthone O

ChEBI IDCHEBI:214155
ChEBI NameVersixanthone O
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SubmitterMetaboLights
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FormulaC32H30O14
Net Charge0
Average Mass638.578
Monoisotopic Mass638.16356
SMILESCOC(=O)[C@@]12Oc3cc(C)c(-c4ccc(O)c5c4O[C@]4(C(=O)OC)C(=C5O)C(=O)C[C@H](C)[C@H]4O)c(O)c3C(O)=C1C(=O)CC[C@H]2O
InChIInChI=1S/C32H30O14/c1-11-10-17-21(26(39)22-15(34)7-8-18(36)31(22,45-17)29(41)43-3)24(37)19(11)13-5-6-14(33)20-25(38)23-16(35)9-12(2)28(40)32(23,30(42)44-4)46-27(13)20/h5-6,10,12,18,28,33,36-40H,7-9H2,1-4H3/t12-,18+,28+,31-,32+/m0/s1
InChIKeyRBOLEWXSTOYYEK-RYGOELPRSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (30223483)
ChEBI Ontology
Outgoing Relation(s)
Versixanthone O (CHEBI:214155) is a xanthenes (CHEBI:38835)
IUPAC Name 
methyl (4R,4aR)-7-[(5R,6S,10aR)-1,5,9-trihydroxy-10a-methoxycarbonyl-6-methyl-8-oxo-6,7-dihydro-5H-xanthen-4-yl]-4,8,9-trihydroxy-6-methyl-1-oxo-3,4-dihydro-2H-xanthene-4a-carboxylate
Manual XrefsDatabases
78439281ChemSpider