| SpectraBase Compound ID | Bl5QfbNEnGE |
|---|---|
| InChI | InChI=1S/C27H46O2/c1-18(17-28)6-5-7-19(2)23-10-11-24-22-9-8-20-16-21(29)12-14-26(20,3)25(22)13-15-27(23,24)4/h9,18-21,23-25,28-29H,5-8,10-17H2,1-4H3/t18-,19+,20-,21-,23+,24-,25-,26-,27+/m0/s1 |
| InChIKey | KATOJKSBOJTNHO-PHKFRDKFSA-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 | 5b4rhyLiDe8 |
|---|---|
| Name | 26-Hydroxy-5.alpha.-cholest-7-en-3.beta.-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H46O2 |
| InChI | InChI=1S/C27H46O2/c1-18(17-28)6-5-7-19(2)23-10-11-24-22-9-8-20-16-21(29)12-14-26(20,3)25(22)13-15-27(23,24)4/h9,18-21,23-25,28-29H,5-8,10-17H2,1-4H3/t18-,19+,20-,21-,23+,24-,25-,26-,27+/m0/s1 |
| InChIKey | KATOJKSBOJTNHO-PHKFRDKFSA-N |
| Molecular Weight | 402.663 g/mol |
| SMILES | OC[C@](CCC[C@]([C@@]1([C@@]2([C@](C3=CC[C@]4(C[C@](CC[C@@]4([C@]3(CC2)[H])C)(O)[H])[H])(CC1)[H])C)[H])(C)[H])(C)[H] |
| SPLASH | splash10-0udi-0062900000-52fc7e50b9228c2b23aa |
| Source of Spectrum | U1-2009-3710-16 |
| Synonyms | (3S,5S,9R,10S,13R,14R,17R)-17-[(2R,6S)-7-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol (3S,5S,9R,10S,13R,14R,17R)-10,13-dimethyl-17-[(2R,6S)-6-methyl-7-oxidanyl-heptan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Wiley ID | 1697000 |