Chem
J-GLOBAL ID：200907036078682544   Nikkaji number：J883.596I

11-Oxoolean-12-en-3β-ol acetate

酢酸11-オキソオレアナ-12-エン-3β-イル
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： C32H50O3
Molecular formula furigana： C32-H50-O3
Molecular weight： 482.749
InChI： InChI=1S/C32H50O3/c1-20(33)35-25-11-12-30(7)24(28(25,4)5)10-13-32(9)26(30)23(34)18-21-22-19-27(2,3)14-15-29(22,6)16-17-31(21,32)8/h18,22,24-26H,10-17,19H2,1-9H3/t22-,24-,25-,26+,29+,30-,31+,32+/m0/s1
InChI key： SOINDUWJQBFDIH-BJFAYYBWSA-N
SMILES： CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2C(=O)C=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@@]32C)C1(C)C
Systematic name  (5)：
  • 11-オキソオレアナ-12-エン-3β-オールアセタート
  • 酢酸11-オキソオレアナ-12-エン-3β-イル
  • 11-オキソオレアナン-12-エン-3β-オールアセタート
  • (3S,4aR,6aR,6bS,8aR,12aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-オクタメチル-14-オキソ-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-イコサヒドロピセン-3-イル アセタート
  • (3S,4aR,6aR,6bS,8aR,12aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-14-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl acetate
Other name (3)：
  • 11-Oxoolean-12-en-3β-ol acetate
  • Acetic acid 11-oxooleana-12-ene-3β-yl ester
  • 11-Oxooleanane-12-ene-3β-ol acetate
Thsaurus map：
Thesaurus Map

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