Chem
J-GLOBAL ID:200907050483866035   Nikkaji number:J1.389.221K

4-[2-Propyl-3-[3-[2-(1-propenyl)-3-hydroxy-4-acetylphenylsulfonyl]propoxy]-6-acetylphenoxy]butyric acid

4-[2-プロピル-3-[3-[2-(1-プロペニル)-3-ヒドロキシ-4-アセチルフェニルスルホニル]プロポキシ]-6-アセチルフェノキシ]酪酸
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: C29H36O9S
Molecular formula furigana: C29-H36-O9-S
Molecular weight: 560.660
InChI: InChI=1S/C29H36O9S/c1-5-9-23-25(14-12-22(20(4)31)29(23)38-16-7-11-27(32)33)37-17-8-18-39(35,36)26-15-13-21(19(3)30)28(34)24(26)10-6-2/h6,10,12-15,34H,5,7-9,11,16-18H2,1-4H3,(H,32,33)
InChI key: WYHWRNWLWXSZEP-UHFFFAOYSA-N
SMILES: CCCc1c(OCCCS(=O)(=O)c2ccc(C(=O)C)c(O)c2C=CC)ccc(C(=O)C)c1OCCCC(=O)O
Systematic name  (3):
  • 4-[2-プロピル-3-[3-[2-(1-プロペニル)-3-ヒドロキシ-4-アセチルフェニルスルホニル]プロポキシ]-6-アセチルフェノキシ]酪酸
  • 4-(6-アセチル-3-{3-[4-アセチル-3-ヒドロキシ-2-(プロパ-1-エン-1-イル)ベンゼンスルホニル]プロポキシ}-2-プロピルフェノキシ)ブタン酸
  • 4-(6-acetyl-3-{3-[4-acetyl-3-hydroxy-2-(prop-1-en-1-yl)benzenesulfonyl]propoxy}-2-propylphenoxy)butanoic acid
Other name (1):
  • 4-[2-Propyl-3-[3-[2-(1-propenyl)-3-hydroxy-4-acetylphenylsulfonyl]propoxy]-6-acetylphenoxy]butyric acid
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