Chem
J-GLOBAL ID：200907073079720604   Nikkaji number：J431.685A

Retinoyl β-D-glucuronide

レチノイルβ-D-グルクロニド
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： C26H36O8
Molecular formula furigana： C26-H36-O8
Molecular weight： 476.566
InChI： InChI=1S/C26H36O8/c1-15(11-12-18-17(3)10-7-13-26(18,4)5)8-6-9-16(2)14-19(27)33-25-22(30)20(28)21(29)23(34-25)24(31)32/h6,8-9,11-12,14,20-23,25,28-30H,7,10,13H2,1-5H3,(H,31,32)/b9-6+,12-11+,15-8+,16-14+/t20-,21-,22+,23-,25+/m0/s1
InChI key： MTGFYEHKPMOVNE-NEFMKCFNSA-N
SMILES： C/C(=C\C=C\C(=C\C(=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O)\C)/C=C/C1=C(C)CCCC1(C)C
Systematic name  (10)：
  • レチノイル-β-D-グルクロニド
  • レチノイルβ-D-グルコピラノシドウロン酸
  • レチノイル-β-D-グルクロノピラノシド
  • レチノイルβ-D-グルクロノピラノシド
  • [(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)-1-オキソ-2,4,6,8-ノナテトラエニル]β-D-グルコピラノシドウロン酸
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Other name (18)：
  • Retinoyl-β-D-glucuronopyranoside
  • Retinoyl β-D-glucopyranosiduronic acid
  • all-trans-レチノイルグルクロニド
  • Retinoyl β-D-glucuronopyranoside
  • レチノイルβ-グルクロニド
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KEGG COMPOUND： C11061
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