Chem
J-GLOBAL ID:200907019578837976   Nikkaji number:J680.842E

2-Phenylthio-3,4-dihydroxy-5-(benzyloxy)benzoic acid benzyl ester

2-フェニルチオ-3,4-ジヒドロキシ-5-(ベンジルオキシ)安息香酸ベンジル
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: C27H22O5S
Molecular formula furigana: C27-H22-O5-S
Molecular weight: 458.530
InChI: InChI=1S/C27H22O5S/c28-24-23(31-17-19-10-4-1-5-11-19)16-22(27(30)32-18-20-12-6-2-7-13-20)26(25(24)29)33-21-14-8-3-9-15-21/h1-16,28-29H,17-18H2
InChI key: GAEYAVFPHCAFMI-UHFFFAOYSA-N
SMILES: Oc1c(O)c(Sc2ccccc2)c(cc1OCc1ccccc1)C(=O)OCc1ccccc1
Systematic name  (4):
  • 2-(フェニルチオ)-3,4-ジヒドロキシ-5-(ベンジルオキシ)安息香酸ベンジル
  • 2-フェニルチオ-3,4-ジヒドロキシ-5-(ベンジルオキシ)安息香酸ベンジル
  • ベンジル 5-(ベンジルオキシ)-3,4-ジヒドロキシ-2-(フェニルスルファニル)ベンゾアート
  • benzyl 5-(benzyloxy)-3,4-dihydroxy-2-(phenylsulfanyl)benzoate
Other name (1):
  • 2-Phenylthio-3,4-dihydroxy-5-(benzyloxy)benzoic acid benzyl ester
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