| SpectraBase Spectrum ID |
2CK2gUOxDw7 |
| Name |
Androstane-3,7,12,17-tetrol, 3,7,12-triacetate 17-(acetate-D3), (3.alpha.,5.beta.,7.alpha.,12.alpha.,17.beta.)- |
| CAS Registry Number |
69889-77-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H37D3O8 |
| InChI |
InChI=1S/C27H40O8/c1-14(28)32-19-9-10-26(5)18(11-19)12-22(33-15(2)29)25-20-7-8-23(34-16(3)30)27(20,6)24(13-21(25)26)35-17(4)31/h18-25H,7-13H2,1-6H3/t18?,19-,20+,21+,22-,23?,24+,25+,26+,27+/m1/s1/i3D3 |
| InChIKey |
ZUQBKMLRGSFJPR-IYVBOKFUSA-N |
| Molecular Weight |
495.627 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3([C@@](CC4[C@@]([C@]3(C[C@@]2(OC(=O)C)[H])[H])(CC[C@@](OC(=O)C)(C4)[H])C)(OC(=O)C)[H])[H])(CCC1OC(=O)C([2D])([2D])[2D])[H])C |
| SPLASH |
splash10-0udr-0093100000-2d7ae2a69a98df464870 |
| Source of Spectrum |
O-13-407-3 |
| Synonyms |
3.alpha.,7.alpha.,12.alpha.-triacetoxy-17-trideuteroacetoxyandrostane |
| Wiley ID |
1397559 |
