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CHEBI:228121 - Ascomindone C

Default Structure
ChEBI IDCHEBI:228121
ChEBI NameAscomindone C
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SubmitterMetaboLights
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FormulaC32H24O10
Net Charge0
Average Mass568.534
Monoisotopic Mass568.13695
SMILESCOc1cc2c(c(C3=C(c4c(O)cc(C)cc4O)c4c(O)cc(OC)cc4C3=O)c1)Oc1cc(C)cc(O)c1C(=O)O2
InChIInChI=1S/C32H24O10/c1-13-5-19(33)27(20(34)6-13)29-25-17(9-15(39-3)11-22(25)36)30(37)26(29)18-10-16(40-4)12-24-31(18)41-23-8-14(2)7-21(35)28(23)32(38)42-24/h5-12,33-36H,1-4H3
InChIKeyUXBAMDSIAPBRIA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Ascomindone C (CHEBI:228121) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
1-[3-(2,6-dihydroxy-4-methylphenyl)-4-hydroxy-6-methoxy-1-oxoinden-2-yl]-7-hydroxy-3-methoxy-9-methylbenzo[b][1,4]benzodioxepin-6-one
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