| SpectraBase Spectrum ID |
6XmbDeKDlRh |
| Name |
3-HYDROXYPREGN-5-EN-20-ONE |
| CAS Registry Number |
38372-24-6 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
316.240230268 u |
| Formula |
C21H32O2 |
| InChI |
InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19,23H,5-12H2,1-3H3/t15?,16-,17+,18-,19-,20-,21+/m0/s1 |
| InChIKey |
ORNBQBCIOKFOEO-OZIWPBGVSA-N |
| Molecular Weight |
316.485 g/mol |
| Nominal Mass |
316 u |
| Number of Peaks |
170 |
| SMILES |
OC1CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CC=C2C1)[H])[H])(C(C)=O)[H])C)[H])C |
| SPLASH |
splash10-0006-9830000000-79c3dcaa18b3285ab01d |
| Source File Reference |
LMCM-28743-463P |
| Source of Spectrum |
Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany |
| Synonyms |
1-[(1S,2R,10S,11S,14S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl]ethan-1-one |
| Wiley ID |
8_30196 |
