| SpectraBase Compound ID | 9bT6nhevd4M |
|---|---|
| InChI | InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,19-20,22-25,27,31H,2,7-15,17H2,1,3-6H3/t19-,20?,22+,23-,24+,25+,27-,28-,29-/m1/s1 |
| InChIKey | AENJXYQUUKMTKX-RPVWXLAGSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C29H46O2 |
| Exact Mass | 426.349781 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ke95DM72PWS |
|---|---|
| Name | 24-Ethyl-3-oxocholesta-4,25-dien-6.beta.-ol |
| Alternate Name(s) | (6beta)-6-hydroxystigmasta-4,25-dien-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H46O2 |
| InChI | InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,19-20,22-25,27,31H,2,7-15,17H2,1,3-6H3/t19-,20?,22+,23-,24+,25+,27-,28-,29-/m1/s1 |
| InChIKey | AENJXYQUUKMTKX-RPVWXLAGSA-N |
| Molecular Weight | 426.685 g/mol |
| SMILES | O[C@]1(C2=CC(CC[C@@]2([C@@]2([C@@](C1)([C@@]1(CC[C@]([C@@](CCC(C(=C)C)CC)(C)[H])([C@@]1(C)CC2)[H])[H])[H])[H])C)=O)[H] |
| SPLASH | splash10-002f-0069600000-afb252e889e3811f2591 |
| Source of Spectrum | G4-58-1525-2 |
| Wiley ID | 1606037 |