Chem
J-GLOBAL ID：200907082321215846   Nikkaji number：J612.549B

Bexarotene

ベキサロテン
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： C24H28O2
Molecular formula furigana： C24-H28-O2
Molecular weight： 348.486
InChI： InChI=1S/C24H28O2/c1-15-13-20-21(24(5,6)12-11-23(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)22(25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,25,26)
InChI key： NAVMQTYZDKMPEU-UHFFFAOYSA-N
SMILES： Cc1cc2c(cc1C(=C)c1ccc(cc1)C(=O)O)C(C)(C)CCC2(C)C
Systematic name  (8)：
  • 4-[1-[(5,6,7,8-テトラヒドロ-3,5,5,8,8-ペンタメチルナフタレン)-2-イル]エテニル]安息香酸
  • 4-[1-(1,1,4,4,7-ペンタメチルテトラリン-6-イル)エテニル]安息香酸
  • 4-[1-(1,2,3,4-テトラヒドロ-1,1,4,4,7-ペンタメチルナフタレン-6-イル)エテニル]安息香酸
  • 4-[1-(3,5,5,8,8-ペンタメチル-5,6,7,8-テトラヒドロナフタレン-2-イル)エテニル]安息香酸
  • 4-[1-(1,1,4,4,7-ペンタメチル-1,2,3,4-テトラヒドロナフタレン-6-イル)ビニル]安息香酸
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Other name (19)：
  • LGD-1069
  • L-1069
  • SR-11247
  • 4-[1-(1,1,4,4,7-Pentamethyltetralin-6-yl)ethenyl]benzoic acid
  • 4-[1-[(5,6,7,8-Tetrahydro-3,5,5,8,8-pentamethylnaphthalen)-2-yl]ethenyl]benzoic acid
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CAS registry number： 153559-49-0
KEGG DRUG： D03106
Application (3)：
antitumor drug ,  T cell lymphoma ,  vitamin A
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