| SpectraBase Spectrum ID |
Hn39tLGLxJ0 |
| Name |
Methanesulfonic acid (1R,4aR,8aS,9S)-9-(2-chloro-ethyl)-9-hydroxy-7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,4b,5,6,8a,9,10,10a-dodecahydro-phenanthren-1-ylmethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H39ClO4S |
| InChI |
InChI=1S/C23H39ClO4S/c1-16(2)17-7-8-18-19(13-17)23(25,11-12-24)14-20-21(3,15-28-29(5,26)27)9-6-10-22(18,20)4/h13,16,18-20,25H,6-12,14-15H2,1-5H3/t18?,19-,20?,21-,22+,23+/m0/s1 |
| InChIKey |
QYBDJYADMOKJIY-LPOHXBMASA-N |
| Molecular Weight |
447.074 g/mol |
| SMILES |
O[C@@]1(CC2[C@@](C3[C@@]1(C=C(CC3)C(C)C)[H])(CCC[C@]2(COS(=O)(=O)C)C)C)CCCl |
| SPLASH |
splash10-000t-0003900000-5353bf06c7fa8a446d1d |
| Source of Spectrum |
AH-133-237-10 |
| Synonyms |
(4beta,7alpha)-7-(2-chloroethyl)-7-hydroxyabiet-13-en-18-yl methanesulfonate
[Dodecahydro-9'-(2''-chloroethyl)-9'-hydroxy-1'-(hydroxymethyl)-1',4'a-dimethyl-7'-(1''-methylethyl)phenanthren-1'-yl]-methyl methanesulfonate |
| Wiley ID |
1546633 |
