| SpectraBase Spectrum ID |
L2R11q3BokZ |
| Name |
5.ALPHA.-ANDROSTANE-3.BETA.,16.ALPHA.,17.BETA.-TRIOL(3.BETA.,16.ALPHA.,17.BETA.-TRI-ACETATE) |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
434.266838938 u |
| Formula |
C25H38O6 |
| InChI |
InChI=1S/C25H38O6/c1-14(26)29-18-8-10-24(4)17(12-18)6-7-19-20(24)9-11-25(5)21(19)13-22(30-15(2)27)23(25)31-16(3)28/h17-23H,6-13H2,1-5H3/t17-,18-,19+,20-,21-,22+,23-,24-,25-/m0/s1 |
| InChIKey |
HSGVMDCMKQIIEL-DRMSUILTSA-N |
| Molecular Weight |
434.573 g/mol |
| Nominal Mass |
434 u |
| Number of Peaks |
122 |
| SMILES |
[C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@]([C@@](C[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])(OC(C)=O)[H])(OC(C)=O)[H])C)[H])C)(OC(C)=O)[H] |
| SPLASH |
splash10-014i-1696000000-33cd30a6586288b4c113 |
| Source File Reference |
LMCM-79827-765Q |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
16,17-BIS(ACETYLOXY)ANDROSTAN-3-YL ACETATE
(3S,5S,8R,9S,10S,13S,14S,16R,17R)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,16,17-triyl triacetate |
| Wiley ID |
4_5 |
