| SpectraBase Spectrum ID |
4DzbcynAnrf |
| Name |
5(R)-3,6-Cyclo-4-nor-3,5-seco-6-.beta.-androstane-3.alpha.,5,17.beta.-triol 3-Acetate 17-Propionate 5-Thiobenzoate |
| Alternate Name(s) |
(3aS,3bR,6R,8aR,8bS,10aS)-6-(acetyloxy)-5-(benzothioyloxy)-8a,10a-dimethylhexadecahydrodicyclopenta[a,f]naphthalen-1-yl propionate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H40O5S |
| InChI |
InChI=1S/C30H40O5S/c1-5-26(32)35-25-12-11-21-20-17-24(34-28(36)19-9-7-6-8-10-19)27-23(33-18(2)31)14-16-30(27,4)22(20)13-15-29(21,25)3/h6-10,20-25,27H,5,11-17H2,1-4H3/t20-,21-,22-,23+,24?,25?,27?,29-,30+/m0/s1 |
| InChIKey |
VJHMLACZQWVFNN-GLXRXSEXSA-N |
| Molecular Weight |
512.705 g/mol |
| SMILES |
[C@@]12(C(C(OC(=S)c3ccccc3)C[C@@]3([C@@]1(CC[C@@]1(C(OC(=O)CC)CC[C@@]31[H])C)[H])[H])[C@](OC(=O)C)(CC2)[H])C |
| SPLASH |
splash10-03di-0039000000-ce8ee42660c408e5319a |
| Source of Spectrum |
KC-1991-131-19 |
| Wiley ID |
1400850 |
