| SpectraBase Spectrum ID |
7flQnK25IpT |
| Name |
ANDROST-5-ENE-3.BETA.,19-DIOL-17-ONE-3.BETA.,19-DI-ACETATE |
| CAS Registry Number |
2857-44-5 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
388.224974125 u |
| Formula |
C23H32O5 |
| InChI |
InChI=1S/C23H32O5/c1-14(24)27-13-23-11-8-17(28-15(2)25)12-16(23)4-5-18-19-6-7-21(26)22(19,3)10-9-20(18)23/h4,17-20H,5-13H2,1-3H3/t17-,18-,19-,20-,22-,23+/m0/s1 |
| InChIKey |
PSRDCTIJVCDHCN-AEZRXPCCSA-N |
| Molecular Weight |
388.504 g/mol |
| Nominal Mass |
388 u |
| Number of Peaks |
144 |
| SMILES |
[C@]1(CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CC=C2C1)[H])[H])=O)C)[H])COC(C)=O)(OC(C)=O)[H] |
| SPLASH |
splash10-014i-2590000000-d86c8b998b787d6c36f7 |
| Source File Reference |
LMCM-28752-334F |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
19-(ACETYLOXY)-17-OXOANDROST-5-EN-3-YL ACETATE
((3S,8R,9S,10S,13S,14S)-3-acetoxy-13-methyl-17-oxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-10-yl)methyl acetate |
| Wiley ID |
4_2442 |
