| SpectraBase Spectrum ID |
8P4iLulylM8 |
| Name |
3.BETA.,17.ALPHA.,20.BETA.-TRIHYDROXY-5.ALPHA.-PREGNANE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
336.266445016 u |
| Formula |
C21H36O3 |
| InChI |
InChI=1S/C21H36O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h13-18,22-24H,4-12H2,1-3H3/t13-,14-,15-,16+,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey |
SCPADBBISMMJAW-LEKZYSGJSA-N |
| Molecular Weight |
336.516 g/mol |
| Nominal Mass |
336 u |
| Number of Peaks |
119 |
| SMILES |
O[C@]([C@]1(CC[C@]2([C@@]3(CC[C@]4(C[C@](CC[C@@]4([C@]3(CC[C@]12C)[H])C)(O)[H])[H])[H])[H])O)(C)[H] |
| SPLASH |
splash10-05fu-7981000000-0bf103868f67e67fe131 |
| Source File Reference |
LMCM-64416-592D |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
PREGNANE-3,17,20-TRIOL
(3S,5S,8R,9S,10S,13S,14S,17R)-17-((S)-1-hydroxyethyl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol |
| Wiley ID |
4_242 |
