Chem
J-GLOBAL ID：200907030396551680   Nikkaji number：J401.558D

Lifibrol

リフィブロール
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： C21H26O4
Molecular formula furigana： C21-H26-O4
Molecular weight： 342.435
InChI： InChI=1S/C21H26O4/c1-21(2,3)17-9-4-15(5-10-17)6-11-18(22)14-25-19-12-7-16(8-13-19)20(23)24/h4-5,7-10,12-13,18,22H,6,11,14H2,1-3H3,(H,23,24)
InChI key： LNXBEIZREVRNTF-UHFFFAOYSA-N
SMILES： CC(C)(C)c1ccc(CCC(O)COc2ccc(cc2)C(=O)O)cc1
Systematic name  (4)：
  • 4-[2-ヒドロキシ-4-(4-tert-ブチルフェニル)ブトキシ]安息香酸
  • 4-[4-[4-(1,1-ジメチルエチル)フェニル]-2-ヒドロキシブトキシ]安息香酸
  • 4-[4-(4-tert-ブチルフェニル)-2-ヒドロキシブトキシ]安息香酸
  • 4-[4-(4-tert-butylphenyl)-2-hydroxybutoxy]benzoic acid
Other name (5)：
  • K-12.148
  • 4-[4-[4-(1,1-Dimethylethyl)phenyl]-2-hydroxybutoxy]benzoic acid
  • K-12148
  • リフィブロール
  • Lifibrol
CAS registry number： 96609-16-4
KEGG DRUG： D04737
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