| SpectraBase Spectrum ID |
BxrSpDSEwmX |
| Name |
11.beta.-(1-Ethenyl)-21-chloro-(17.alpha.,20Z)-19-norpregna-1,3,5(10),20-tetraene-3,17.beta.-diol |
| Alternate Name(s) |
(11beta,17beta)-17-[(Z)-2-chloroethenyl]-11-vinylestra-1,3,5(10)-triene-3,17-diol
(8S,9S,11R,13S,14S,17R)-17-[(Z)-2-chloroethenyl]-11-ethenyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
(8S,9S,11R,13S,14S,17R)-17-[(Z)-2-chloranylethenyl]-11-ethenyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H27ClO2 |
| InChI |
InChI=1S/C22H27ClO2/c1-3-14-13-21(2)19(8-9-22(21,25)10-11-23)18-6-4-15-12-16(24)5-7-17(15)20(14)18/h3,5,7,10-12,14,18-20,24-25H,1,4,6,8-9,13H2,2H3/b11-10-/t14-,18-,19-,20+,21-,22+/m0/s1 |
| InChIKey |
SSQWPMLTYOGGLM-XITZMQDRSA-N |
| Molecular Weight |
358.909 g/mol |
| SMILES |
Oc1ccc2c(CC[C@]3([C@]4([C@@]([C@@](CC4)(\C=C/Cl)O)(C[C@@]([C@]23[H])(C=C)[H])C)[H])[H])c1 |
| SPLASH |
splash10-0007-0029000000-053d6afcb9db587ce330 |
| Source of Spectrum |
F2-41-4691-6 |
| Wiley ID |
1599894 |
