Chem
J-GLOBAL ID:200907072510248601   Nikkaji number:J1.034.477H

3-Hydroxy-2,20-dioxo-24,29,30-trinor-21,22-secofriedela-1(10),3,5,7-tetren-22-al

3-ヒドロキシ-2,20-ジオキソ-24,29,30-トリノル-21,22-セコフリーデラ-1(10),3,5,7-テトラエン-22-アール
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: C27H34O4
Molecular formula furigana: C27-H34-O4
Molecular weight: 422.565
InChI: InChI=1S/C27H34O4/c1-16(29)13-22-24(3,15-28)9-11-26(5)21-8-7-18-17(2)23(31)20(30)14-19(18)25(21,4)10-12-27(22,26)6/h7-8,14-15,22,31H,9-13H2,1-6H3/t22-,24+,25+,26-,27+/m1/s1
InChI key: UZLRIJBWQKBEHG-UOJUTNHLSA-N
SMILES: CC(=O)C[C@@H]1[C@@](C)(CC[C@]2(C)C3=CC=C4C(=C(O)C(=O)C=C4[C@]3(C)CC[C@@]12C)C)C=O
Systematic name  (3):
  • 3-ヒドロキシ-2,20-ジオキソ-24,29,30-トリノル-21,22-セコフリーデラ-1(10),3,5,7-テトラエン-22-アール
  • (1S,2R,4aS,10bR,12aS)-8-ヒドロキシ-2,4a,7,10b,12a-ペンタメチル-9-オキソ-1-(2-オキソプロピル)-1,2,3,4,4a,9,10b,11,12,12a-デカヒドロクリセン-2-カルバルデヒド
  • (1S,2R,4aS,10bR,12aS)-8-hydroxy-2,4a,7,10b,12a-pentamethyl-9-oxo-1-(2-oxopropyl)-1,2,3,4,4a,9,10b,11,12,12a-decahydrochrysene-2-carbaldehyde
Other name (1):
  • 3-Hydroxy-2,20-dioxo-24,29,30-trinor-21,22-secofriedela-1(10),3,5,7-tetren-22-al
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