| SpectraBase Compound ID | 7nfpQeva2Hw |
|---|---|
| InChI | InChI=1S/C24H40O3/c1-15(5-4-12-25)19-8-9-20-18-7-6-16-13-17(26)10-11-23(16,2)21(18)14-22(27)24(19,20)3/h7,15-17,19-22,25-27H,4-6,8-14H2,1-3H3 |
| InChIKey | AESFWEGZDUOISG-UHFFFAOYSA-N |
| Mol Weight | 376.6 g/mol |
| Molecular Formula | C24H40O3 |
| Exact Mass | 376.297745 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HCQ8rFk8EUb |
|---|---|
| Name | Chol-7-ene-3,12,24-triol, (3.alpha.,5.beta.,12.alpha.)- |
| CAS Registry Number | 54411-71-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H40O3 |
| InChI | InChI=1S/C24H40O3/c1-15(5-4-12-25)19-8-9-20-18-7-6-16-13-17(26)10-11-23(16,2)21(18)14-22(27)24(19,20)3/h7,15-17,19-22,25-27H,4-6,8-14H2,1-3H3 |
| InChIKey | AESFWEGZDUOISG-UHFFFAOYSA-N |
| Molecular Weight | 376.581 g/mol |
| SMILES | OC1CC2C(C3C1(C(C(CCCO)C)CC3)C)=CCC1C2(C)CCC(C1)O |
| SPLASH | splash10-0zmi-5692000000-0d9393eed679b731296c |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | Chol-7-ene-3,12,24-triol 10,13-dimethyl-17-(5-oxidanylpentan-2-yl)-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol 17-(4-hydroxy-1-methyl-butyl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol 17-(5-hydroxypentan-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol |
| Wiley ID | 1358029 |