| SpectraBase Spectrum ID |
2cmCgu0eT2C |
| Name |
Pregnan-3-ol, 20-methyl-21-[2-methyl-3-(1-methylethyl)cyclopropyl]-, [3.beta.,5.alpha.,20R,21(1S,2R,3R)]- |
| CAS Registry Number |
83542-17-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H50O |
| InChI |
InChI=1S/C29H50O/c1-17(2)27-19(4)23(27)15-18(3)24-9-10-25-22-8-7-20-16-21(30)11-13-28(20,5)26(22)12-14-29(24,25)6/h17-27,30H,7-16H2,1-6H3/t18-,19-,20+,21+,22?,23+,24?,25?,26?,27-,28?,29?/m1/s1 |
| InChIKey |
YQSCMUYRADBXNP-STTPVRGTSA-N |
| Molecular Weight |
414.718 g/mol |
| SMILES |
O[C@]1(CCC2(C3CCC4(C([C@@](C[C@]5([C@@](C)([C@]5(C(C)C)[H])[H])[H])(C)[H])CCC4C3CC[C@]2(C1)[H])C)C)[H] |
| SPLASH |
splash10-00xr-0093100000-cb7229211ff8971d1701 |
| Source of Spectrum |
C-104-6731-0 |
| Synonyms |
(23R,24S,28S)-23,24-dihydrocalystanol
(23S,24S,28sZ)-23,28-dihydrocalystan-3.beta.-ol
(5S,7S)-2,15-dimethyl-14-[(2R)-1-[(1S,2R,3R)-2-methyl-3-(propan-2-yl)cyclopropyl]propan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-ol |
| Wiley ID |
1375795 |
![Pregnan-3-ol, 20-methyl-21-[2-methyl-3-(1-methylethyl)cyclopropyl]-, [3.beta.,5.alpha.,20R,21(1S,2R,3R)]-](/api/spectrum/2cmCgu0eT2C/structure.png?h=300&w=458 "Pregnan-3-ol, 20-methyl-21-[2-methyl-3-(1-methylethyl)cyclopropyl]-, [3.beta.,5.alpha.,20R,21(1S,2R,3R)]-")
