| SpectraBase Spectrum ID |
8yHWszyMlmk |
| Name |
Pregnane-3,20-diol, 18-iodo-, diacetate, (3.beta.,5.alpha.,20R)- |
| CAS Registry Number |
53864-98-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H39IO4 |
| InChI |
InChI=1S/C25H39IO4/c1-15(29-16(2)27)21-7-8-23-20-6-5-18-13-19(30-17(3)28)9-11-24(18,4)22(20)10-12-25(21,23)14-26/h15,18-23H,5-14H2,1-4H3/t15-,18+,19+,20-,21-,22+,23+,24+,25+/m1/s1 |
| InChIKey |
VFPRJZCJCHBBJE-PRZYBEGVSA-N |
| Molecular Weight |
530.487 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])[H])(CC[C@@]1([C@](OC(=O)C)(C)[H])[H])[H])CI |
| SPLASH |
splash10-000x-9040200000-f8aa9711e4fb0f293a84 |
| Source of Spectrum |
F-34-1532-0 |
| Synonyms |
(3beta,5alpha,20R)-20-(acetyloxy)-18-iodopregnan-3-yl acetate
Diacetoxy-3.beta., (20R)iodo-18-pregnane-5.alpha. |
| Wiley ID |
1403298 |
