Chem
J-GLOBAL ID:200907035948173881   Nikkaji number:J261.795A

13-cis-Acitretin

13-cis-アシトレチン
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: C21H26O3
Molecular formula furigana: C21-H26-O3
Molecular weight: 326.436
InChI: InChI=1S/C21H26O3/c1-14(8-7-9-15(2)12-21(22)23)10-11-19-16(3)13-20(24-6)18(5)17(19)4/h7-13H,1-6H3,(H,22,23)/b9-7+,11-10+,14-8+,15-12-
InChI key: IHUNBGSDBOWDMA-UGOGCBOOSA-N
SMILES: COc1cc(C)c(/C=C/C(=C/C=C/C(=C\C(=O)O)/C)/C)c(C)c1C
Systematic name  (4):
  • (2Z,4E,6E,8E)-9-(2,3,6-トリメチル-4-メトキシフェニル)-3,7-ジメチル-2,4,6,8-ノナテトラエン酸
  • (2Z,4E,6E,8E)-9-(4-メトキシ-2,3,6-トリメチルフェニル)-3,7-ジメチル-2,4,6,8-ノナテトラエン酸
  • (2Z,4E,6E,8E)-9-(4-メトキシ-2,3,6-トリメチルフェニル)-3,7-ジメチルノナ-2,4,6,8-テトラエン酸
  • (2Z,4E,6E,8E)-9-(4-methoxy-2,3,6-trimethylphenyl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid
Other name (13):
  • 13-シスエトレチン
  • イソアシトレチン
  • 13-シスアシトレチン
  • イソエトレチン
  • Isoetretin
Show all
CAS registry number: 69427-46-9
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