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CHEBI:178216 - Broussinol

ChEBI IDCHEBI:178216
ChEBI NameBroussinol
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SubmitterMetaboLights
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FormulaC20H22O4
Net Charge0
Average Mass326.392
Monoisotopic Mass326.15181
SMILESCC(C)=CCc1cc([C@H]2Oc3cc(O)ccc3C[C@@H]2O)ccc1O
InChIInChI=1S/C20H22O4/c1-12(2)3-4-13-9-15(6-8-17(13)22)20-18(23)10-14-5-7-16(21)11-19(14)24-20/h3,5-9,11,18,20-23H,4,10H2,1-2H3/t18-,20+/m0/s1
InChIKeyPTZNBCJWCJFLPQ-AZUAARDMSA-N
ChEBI Ontology
Outgoing Relation(s)
Broussinol (CHEBI:178216) is a flavans (CHEBI:38672)
IUPAC Name 
(2R,3S)-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-3,4-dihydro-2H-chromene-3,7-diol
Manual XrefsDatabases
24842492ChemSpider
LMPK12020005LIPID MAPS