| SpectraBase Spectrum ID |
JuLzML2B4HP |
| Name |
5a,8a,14b-pregnane-3b,11b-diol |
| Alternate Name(s) |
(3beta,5alpha,8alpha,11beta)-pregnane-3,11-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H36O2 |
| InChI |
InChI=1S/C21H36O2/c1-4-13-6-8-17-16-7-5-14-11-15(22)9-10-20(14,2)19(16)18(23)12-21(13,17)3/h13-19,22-23H,4-12H2,1-3H3/t13?,14-,15-,16+,17?,18-,19?,20-,21+/m0/s1 |
| InChIKey |
IOILQJHGPBLKBM-SNALSRNISA-N |
| Molecular Weight |
320.517 g/mol |
| SMILES |
O[C@@]1(C2[C@]3(CC[C@@](C[C@@]3(CC[C@@]2(C2[C@](C1)(C(CC2)CC)C)[H])[H])(O)[H])C)[H] |
| SPLASH |
splash10-0ab9-5931000000-3a91b8bcf0a4f9d10e7a |
| Source of Spectrum |
SD-1992-0-0 |
| Wiley ID |
1320592 |
