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CHEBI:227178 - Wentiphenone A

ChEBI IDCHEBI:227178
ChEBI NameWentiphenone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O11
Net Charge0
Average Mass450.396
Monoisotopic Mass450.11621
SMILESCOC(=O)c1cc(C)c(C(=O)OC[C@@H](O)CO)c(OC)c1C(=O)c1c(O)cc(O)cc1O
InChIInChI=1S/C21H22O11/c1-9-4-12(20(28)31-3)16(18(27)17-13(25)5-10(23)6-14(17)26)19(30-2)15(9)21(29)32-8-11(24)7-22/h4-6,11,22-26H,7-8H2,1-3H3/t11-/m0/s1
InChIKeyBDEZNTZSCJCFAT-NSHDSACASA-N
Species of MetaboliteComponentSourceComments
Aspergillus wentii (ncbitaxon:5066) - PubMed (31466836)
ChEBI Ontology
Outgoing Relation(s)
Wentiphenone A (CHEBI:227178) is a benzophenones (CHEBI:22726)
IUPAC Name 
4-O-[(2S)-2,3-dihydroxypropyl] 1-O-methyl 3-methoxy-5-methyl-2-(2,4,6-trihydroxybenzoyl)benzene-1,4-dicarboxylate