Chem
J-GLOBAL ID：201407059494258646   Nikkaji number：J3.287.028G

Hydroxypinacolone retinoate

ヒドロキシピナコロンレチノアート
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： C26H38O3
Molecular formula furigana： C26-H38-O3
Molecular weight： 398.587
InChI： InChI=1S/C26H38O3/c1-19(14-15-22-21(3)13-10-16-26(22,7)8)11-9-12-20(2)17-24(28)29-18-23(27)25(4,5)6/h9,11-12,14-15,17H,10,13,16,18H2,1-8H3/b12-9+,15-14+,19-11+,20-17+
InChI key： XLPLFRLIWKRQFT-XUJYDZMUSA-N
SMILES： C/C(=C\C=C\C(=C\C(=O)OCC(=O)C(C)(C)C)\C)/C=C/C1=C(C)CCCC1(C)C
Systematic name  (3)：
  • (2E,4E,6E,8E)-3,7-ジメチル-9-(2,6,6-トリメチル-1-シクロヘキセン-1-イル)-2,4,6,8-ノナテトラエン酸2-オキソ-3,3-ジメチルブチル
  • 3,3-ジメチル-2-オキソブチル (2E,4E,6E,8E)-3,7-ジメチル-9-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)ノナ-2,4,6,8-テトラエノアート
  • 3,3-dimethyl-2-oxobutyl (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate
Other name (3)：
  • (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexene-1-yl)-2,4,6,8-nonatetraenoic acid 2-oxo-3,3-dimethylbutyl ester
  • ヒドロキシピナコロンレチノアート
  • Hydroxypinacolone retinoate
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