SpectraBase Compound ID | HZwlA35Y4HQ |
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InChI | InChI=1S/C35H56O2/c1-24(2)10-9-11-25(3)29-16-17-30-28-15-14-27-22-35(37,23-32(36)26-12-7-6-8-13-26)21-20-33(27,4)31(28)18-19-34(29,30)5/h6-8,12-13,24-25,27-32,36-37H,9-11,14-23H2,1-5H3/t25-,27?,28?,29-,30?,31?,32?,33+,34-,35-/m1/s1 |
InChIKey | GNJWOMSBVBJSLW-XOCUHCHRSA-N |
Mol Weight | 508.8 g/mol |
Molecular Formula | C35H56O2 |
Exact Mass | 508.428031 g/mol |
SpectraBase Spectrum ID | JrsJ2Wnkwt9 |
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Name | 3.beta.-[(2-Hydroxy-2-phenyl)ethyl]-5.alpha.-cholestan-3-.alpha.-ol |
Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C35H56O2 |
InChI | InChI=1S/C35H56O2/c1-24(2)10-9-11-25(3)29-16-17-30-28-15-14-27-22-35(37,23-32(36)26-12-7-6-8-13-26)21-20-33(27,4)31(28)18-19-34(29,30)5/h6-8,12-13,24-25,27-32,36-37H,9-11,14-23H2,1-5H3/t25-,27?,28?,29-,30?,31?,32?,33+,34-,35-/m1/s1 |
InChIKey | GNJWOMSBVBJSLW-XOCUHCHRSA-N |
Molecular Weight | 508.831 g/mol |
SMILES | OC(C[C@]1(CC[C@@]2(C3CC[C@]4(C(C3CCC2C1)CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])C)C)O)c1ccccc1 |
SPLASH | splash10-05mp-9020000000-7495febeb439dd05cc58 |
Source of Spectrum | KD-12-807-10 |
Synonyms | 2-[(3alpha)-3-hydroxycholestan-3-yl]-1-phenylethanol |
Wiley ID | 1634305 |