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CHEBI:180155 - 3',4'-Dihydroxy-7-methoxyflavan

ChEBI IDCHEBI:180155
ChEBI Name3',4'-Dihydroxy-7-methoxyflavan
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O4
Net Charge0
Average Mass272.300
Monoisotopic Mass272.10486
SMILESCOc1ccc2c(c1)O[C@H](c1ccc(O)c(O)c1)CC2
InChIInChI=1S/C16H16O4/c1-19-12-5-2-10-4-7-15(20-16(10)9-12)11-3-6-13(17)14(18)8-11/h2-3,5-6,8-9,15,17-18H,4,7H2,1H3/t15-/m0/s1
InChIKeyRFPAIRSYRWTZLD-HNNXBMFYSA-N
ChEBI Ontology
Outgoing Relation(s)
3',4'-Dihydroxy-7-methoxyflavan (CHEBI:180155) is a ether (CHEBI:25698)
3',4'-Dihydroxy-7-methoxyflavan (CHEBI:180155) is a flavonoids (CHEBI:72544)
IUPAC Name 
4-[(2S)-7-methoxy-3,4-dihydro-2H-chromen-2-yl]benzene-1,2-diol
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24842642ChemSpider
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