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CHEBI:175730 - Gancaonin B

ChEBI IDCHEBI:175730
ChEBI NameGancaonin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O6
Net Charge0
Average Mass368.385
Monoisotopic Mass368.12599
SMILESCOc1ccc(-c2coc3cc(O)c(CC=C(C)C)c(O)c3c2=O)cc1O
InChIInChI=1S/C21H20O6/c1-11(2)4-6-13-15(22)9-18-19(20(13)24)21(25)14(10-27-18)12-5-7-17(26-3)16(23)8-12/h4-5,7-10,22-24H,6H2,1-3H3
InChIKeyYQEPOQVRUDADPH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Gancaonin B (CHEBI:175730) is a isoflavanones (CHEBI:38741)
IUPAC Name 
5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one
Manual XrefsDatabases
LMPK12050262LIPID MAPS
4476334ChemSpider
HMDB0038488HMDB
Registry NumbersSources
CAS:124596-86-7ChemIDplus