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CHEBI:175894 - Isolicopyranocoumarin

ChEBI IDCHEBI:175894
ChEBI NameIsolicopyranocoumarin
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SubmitterMetaboLights
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FormulaC21H20O7
Net Charge0
Average Mass384.384
Monoisotopic Mass384.12090
SMILESCOc1c2c(cc3oc(=O)c(-c4ccc(O)cc4O)cc13)OC(C)(C)C(O)C2
InChIInChI=1S/C21H20O7/c1-21(2)18(24)8-14-17(28-21)9-16-13(19(14)26-3)7-12(20(25)27-16)11-5-4-10(22)6-15(11)23/h4-7,9,18,22-24H,8H2,1-3H3
InChIKeyJHGBGRLHQJNGPN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Isolicopyranocoumarin (CHEBI:175894) is a isoflavonoid (CHEBI:50753)
Isolicopyranocoumarin (CHEBI:175894) is a organic hydroxy compound (CHEBI:33822)
IUPAC Name 
7-(2,4-dihydroxyphenyl)-3-hydroxy-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-8-one
Manual XrefsDatabases
HMDB0035479HMDB
8985345ChemSpider