| SpectraBase Spectrum ID |
1vJOeZcZXI9 |
| Name |
3.BETA.-ACETOXY-PREGNA-5,16-DIENE-20-ONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
356.235144887 u |
| Formula |
C23H32O3 |
| InChI |
InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21H,6,8-13H2,1-4H3/t17-,18-,20-,21-,22-,23+/m0/s1 |
| InChIKey |
MZWRIOUCMXPLKV-RFOVXIPZSA-N |
| Molecular Weight |
356.506 g/mol |
| Nominal Mass |
356 u |
| Number of Peaks |
59 |
| SMILES |
[C@]1(CC[C@@]2([C@]3(CC[C@@]4(C(=CC[C@]4([C@@]3(CC=C2C1)[H])[H])C(C)=O)C)[H])C)(OC(=O)C)[H] |
| SPLASH |
splash10-0005-9770000000-50ed1904a384bdaadffb |
| Source File Reference |
LMCM-48958-480X |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
20-OXOPREGNA-5,16-DIEN-3-YL ACETATE
(3S,8R,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate |
| Wiley ID |
4_381 |
