| SpectraBase Spectrum ID |
CrtX1aqH6rM |
| Name |
3.BETA.,7.BETA.-DIHYDROXY-CHOLEST-5-ENE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
402.349780719 u |
| Formula |
C27H46O2 |
| InChI |
InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h16-18,20-25,28-29H,6-15H2,1-5H3/t18-,20+,21-,22+,23+,24+,25+,26+,27-/m1/s1 |
| InChIKey |
OYXZMSRRJOYLLO-KGZHIOMZSA-N |
| Molecular Weight |
402.663 g/mol |
| Nominal Mass |
402 u |
| Number of Peaks |
63 |
| SMILES |
O[C@@]1([C@]2([C@@]3(CC[C@@]([C@]3(CC[C@@]2([C@]2(CC[C@@](CC2=C1)(O)[H])C)[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])[H] |
| SPLASH |
splash10-001i-7309100000-4c3e40b05548b966f772 |
| Source File Reference |
LMCM-81532-956G |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
CHOLEST-5-ENE-3,7-DIOL
(3S,7R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol |
| Wiley ID |
4_506 |
