| SpectraBase Compound ID | 5qUzPcj93ne |
|---|---|
| InChI | InChI=1S/C30H52O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h19-21,23-28H,8-18H2,1-7H3 |
| InChIKey | CVXQLNHSKSSFSQ-UHFFFAOYSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C30H52O2 |
| Exact Mass | 444.396731 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 43z4sjqDaa |
|---|---|
| Name | Ergostan-3-ol, acetate, (3.beta.,5.alpha.)- |
| CAS Registry Number | 4356-09-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H52O2 |
| InChI | InChI=1S/C30H52O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h19-21,23-28H,8-18H2,1-7H3 |
| InChIKey | CVXQLNHSKSSFSQ-UHFFFAOYSA-N |
| Molecular Weight | 444.744 g/mol |
| SMILES | CC(C)C(C)CCC(C)C1CCC2C1(CCC1C2CCC2C1(CCC(C2)OC(=O)C)C)C |
| SPLASH | splash10-016u-9862100000-57a8da5c0bdd4e0775b9 |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | Ergostan-3-yl acetate 5.alpha.-Ergostan-3.beta.-ol, acetate Ergostan-3.beta.-yl acetate Ergostanol acetate Ergostanyl acetate Acetic acid [17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-(1,4,5-trimethylhexyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 1386221 |