| SpectraBase Spectrum ID |
IqHKM7d1JIk |
| Name |
CHOLEST-5-ENE-3.BETA.,20.ALPHA.-DIOL |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
402.349780719 u |
| Formula |
C27H46O2 |
| InChI |
InChI=1S/C27H46O2/c1-18(2)7-6-14-27(5,29)24-11-10-22-21-9-8-19-17-20(28)12-15-25(19,3)23(21)13-16-26(22,24)4/h8,18,20-24,28-29H,6-7,9-17H2,1-5H3/t20-,21-,22-,23-,24-,25-,26-,27+/m0/s1 |
| InChIKey |
MCKLJFJEQRYRQT-MGNSQDQZSA-N |
| Molecular Weight |
402.663 g/mol |
| Nominal Mass |
402 u |
| Number of Peaks |
90 |
| SMILES |
O[C@@]([C@@]1([C@]2(CC[C@@]3([C@]4(CC[C@@](CC4=CC[C@]3([C@@]2(CC1)[H])[H])(O)[H])C)[H])C)[H])(CCCC(C)C)C |
| SPLASH |
splash10-014i-9743000000-7b0c9bf545c35eca1b92 |
| Source File Reference |
LMCM-76054-436C |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
CHOLEST-5-ENE-3,20-DIOL
(3S,8S,9S,10R,13S,14S,17S)-17-((R)-2-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Wiley ID |
4_103 |
