Chem
J-GLOBAL ID:200907063751200163   Nikkaji number:J1.041.411C

TW-95a

4-ヒドロキシ-6-[[1,6,8-トリヒドロキシ-2-(2,4-ジヒドロキシ-6-メチルベンゾイル)-3-ナフチル]メチル]-2H-ピラン-2-オン
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: C24H18O9
Molecular formula furigana: C24-H18-O9
Molecular weight: 450.399
InChI: InChI=1S/C24H18O9/c1-10-2-13(25)7-17(28)20(10)23(31)22-12(5-16-6-15(27)9-19(30)33-16)3-11-4-14(26)8-18(29)21(11)24(22)32/h2-4,6-9,25-29,32H,5H2,1H3
InChI key: PFYRXVPFLPYTPK-UHFFFAOYSA-N
SMILES: Cc1cc(O)cc(O)c1C(=O)c1c(Cc2cc(O)cc(=O)o2)cc2cc(O)cc(O)c2c1O
Systematic name  (4):
  • 6-[(2-オキソ-4-ヒドロキシ-2H-ピラン-6-イル)メチル]-7-(2,4-ジヒドロキシ-6-メチルベンゾイル)-1,3,8-ナフタレントリオール
  • 4-ヒドロキシ-6-[[1,6,8-トリヒドロキシ-2-(2,4-ジヒドロキシ-6-メチルベンゾイル)-3-ナフチル]メチル]-2H-ピラン-2-オン
  • 6-{[3-(2,4-ジヒドロキシ-6-メチルベンゾイル)-4,5,7-トリヒドロキシナフタレン-2-イル]メチル}-4-ヒドロキシ-2H-ピラン-2-オン
  • 6-{[3-(2,4-dihydroxy-6-methylbenzoyl)-4,5,7-trihydroxynaphthalen-2-yl]methyl}-4-hydroxy-2H-pyran-2-one
Other name (3):
  • 6-[(2-Oxo-4-hydroxy-2H-pyran-6-yl)methyl]-7-(2,4-dihydroxy-6-methylbenzoyl)-1,3,8-naphthalenetriol
  • 4-Hydroxy-6-[[1,6,8-trihydroxy-2-(2,4-dihydroxy-6-methylbenzoyl)-3-naphthyl]methyl]-2H-pyran-2-one
  • TW-95a
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