Chem
J-GLOBAL ID：201807006663159729   Nikkaji number：J3.718.412H

3-O-Methylcyanidin

3-O-メチルシアニジン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C16H13O5[O+]
Molecular formula furigana： C16-H13-O6
Molecular weight： 301.273
InChI： InChI=1S/C16H12O6/c1-21-15-7-10-12(19)5-9(17)6-14(10)22-16(15)8-2-3-11(18)13(20)4-8/h2-7H,1H3,(H3-,17,18,19,20)/p+1
InChI key： QLWSWRWMXXKOBO-UHFFFAOYSA-O
SMILES： COc1cc2c(O)cc(O)cc2[o+]c1c1ccc(O)c(O)c1
Systematic name  (3)：
  • 3-メトキシ-5,7-ジヒドロキシ-2-(3,4-ジヒドロキシフェニル)-1-ベンゾピリリウム
  • 2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-3-メトキシ-1λ4-クロメン-1-イリウム
  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-1λ4-chromen-1-ylium
Other name (3)：
  • 3-Methoxy-5,7-dihydroxy-2-(3,4-dihydroxyphenyl)-1-benzopyrylium
  • 3-O-メチルシアニジン
  • 3-O-Methylcyanidin
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