SpectraBase Compound ID | LGo3NXH0TNn |
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InChI | InChI=1S/C31H54O3/c1-8-22(20(2)3)13-18-31(7,33)28-12-11-26-25-10-9-23-19-24(34-21(4)32)14-16-29(23,5)27(25)15-17-30(26,28)6/h20,22-28,33H,8-19H2,1-7H3/t22?,23-,24-,25?,26?,27?,28-,29-,30-,31-/m0/s1 |
InChIKey | BEFDXPFVYIQVAK-CDSDUSFWSA-N |
Mol Weight | 474.8 g/mol |
Molecular Formula | C31H54O3 |
Exact Mass | 474.407296 g/mol |
SpectraBase Spectrum ID | IAw9jxwfCy5 |
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Name | (20S)-20-Hydroxy-5.alpha.-stigmastan-3.beta.-yl acetate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C31H54O3 |
InChI | InChI=1S/C31H54O3/c1-8-22(20(2)3)13-18-31(7,33)28-12-11-26-25-10-9-23-19-24(34-21(4)32)14-16-29(23,5)27(25)15-17-30(26,28)6/h20,22-28,33H,8-19H2,1-7H3/t22?,23-,24-,25?,26?,27?,28-,29-,30-,31-/m0/s1 |
InChIKey | BEFDXPFVYIQVAK-CDSDUSFWSA-N |
Molecular Weight | 474.770 g/mol |
SMILES | O[C@]([C@@]1([C@@]2(C(C3CC[C@@]4([C@@](C3CC2)(CC[C@](OC(=O)C)(C4)[H])C)[H])CC1)C)[H])(CCC(C(C)C)CC)C |
SPLASH | splash10-0pbc-0096200000-9a925fd42e723fe00a16 |
Source of Spectrum | K-2001-2235-33 |
Synonyms | (3beta,5alpha)-20-hydroxystigmastan-3-yl acetate |
Wiley ID | 1579683 |