| SpectraBase Compound ID | 2igEi2dxndf |
|---|---|
| InChI | InChI=1S/C26H44O4/c1-16(6-5-13-30-17(2)27)21-9-10-22-20-8-7-18-14-19(28)11-12-25(18,3)23(20)15-24(29)26(21,22)4/h16,18-24,28-29H,5-15H2,1-4H3/t16-,18-,19-,20+,21-,22+,23+,24+,25+,26-/m1/s1 |
| InChIKey | RDNMYIBSLVGZHZ-UVVIOMTNSA-N |
| Mol Weight | 420.6 g/mol |
| Molecular Formula | C26H44O4 |
| Exact Mass | 420.32396 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AHdvyNkG98c |
|---|---|
| Name | 24-(Acetoxy)-3.alpha.,12.alpha.-dihydroxy-5.beta.-cholane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H44O4 |
| InChI | InChI=1S/C26H44O4/c1-16(6-5-13-30-17(2)27)21-9-10-22-20-8-7-18-14-19(28)11-12-25(18,3)23(20)15-24(29)26(21,22)4/h16,18-24,28-29H,5-15H2,1-4H3/t16-,18-,19-,20+,21-,22+,23+,24+,25+,26-/m1/s1 |
| InChIKey | RDNMYIBSLVGZHZ-UVVIOMTNSA-N |
| Molecular Weight | 420.634 g/mol |
| SMILES | O[C@]1(C[C@@]2([C@]3(CC[C@](C[C@]3(CC[C@]2([C@]2([C@]1([C@](CC2)([C@@](CCCOC(=O)C)(C)[H])[H])C)[H])[H])[H])(O)[H])C)[H])[H] |
| SPLASH | splash10-001i-9096100000-8631b3778283551d3fe9 |
| Source of Spectrum | C-121-6650-16 |
| Wiley ID | 1700244 |