Chem
J-GLOBAL ID：200907036338512362   Nikkaji number：J217.773K

3-O-Methylgallic acid

3-O-メチル没食子酸
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： C8H8O5
Molecular formula furigana： C8-H8-O5
Molecular weight： 184.147
InChI： InChI=1S/C8H8O5/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,9-10H,1H3,(H,11,12)
InChI key： KWCCUYSXAYTNKA-UHFFFAOYSA-N
SMILES： COc1cc(cc(O)c1O)C(=O)O
Systematic name  (5)：
  • 3,4-ジヒドロキシ-5-メトキシ安息香酸
  • 4,5-ジヒドロキシ-3-メトキシ安息香酸
  • 3-メトキシ,4,5-ジヒドロキシ安息香酸
  • 3-メトキシ-4,5-ジヒドロキシ安息香酸
  • 3,4-dihydroxy-5-methoxybenzoic acid
Other name (7)：
  • 3,4-Dihydroxy-5-methoxybenzoic acid
  • 4,5-Dihydroxy-3-methoxybenzoic acid
  • 3-Methoxy,4,5-dihydroxybenzoic acid
  • 3-Methoxy-4,5-dihydroxybenzoic acid
  • 3-O-メチル没食子酸
Show all
CAS registry number： 3934-84-7
Regulation number (1)：
  • EINECS2235128
KEGG COMPOUND： C05616
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