| SpectraBase Compound ID | 6SQlK2p19Br |
|---|---|
| InChI | InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h8,17,19-25,28-29H,6-7,9-16H2,1-5H3/b18-8+ |
| InChIKey | PWODFAPNDHSBRT-QGMBQPNBSA-N |
| Mol Weight | 402.7 g/mol |
| Molecular Formula | C27H46O2 |
| Exact Mass | 402.349781 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FULdX9IZncB |
|---|---|
| Name | Cholest-20(22)-ene-3,6-diol, (3.beta.,5.alpha.,6.alpha.)- |
| CAS Registry Number | 41084-08-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H46O2 |
| InChI | InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h8,17,19-25,28-29H,6-7,9-16H2,1-5H3/b18-8+ |
| InChIKey | PWODFAPNDHSBRT-QGMBQPNBSA-N |
| Molecular Weight | 402.663 g/mol |
| SMILES | OC1C2CC(CCC2(C2CCC3(C(CCC3C2C1)\C(=C\CCC(C)C)C)C)C)O |
| SPLASH | splash10-0uyj-9410100000-4dbfe6bd60a0f3b5f983 |
| Source of Spectrum | J-8-3550-3 |
| Synonyms | (20E)-Cholest-20(22)-ene-3,6-diol 10,13-dimethyl-17-[(E)-6-methylhept-2-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol 17-[(E)-1,5-dimethylhex-1-enyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6-diol |
| Wiley ID | 1370651 |