| SpectraBase Spectrum ID |
ELZrGJ4HZkR |
| Name |
(8S,9S,11R,13S,14S,17R)-11-ethenyl-17-[(E)-2-iodanylethenyl]-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H27IO2 |
| InChI |
InChI=1S/C22H27IO2/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 |
JHGQPAXFBGDNDF-XUOOYTPCSA-N |
| Molecular Weight |
450.360 g/mol |
| SMILES |
Oc1ccc2c(CC[C@]3([C@]4([C@@]([C@@](CC4)(\C=C\I)O)(C[C@@]([C@]23[H])(C=C)[H])C)[H])[H])c1 |
| SPLASH |
splash10-0ff0-0003900000-3cd419df49f70040e9f4 |
| Source of Spectrum |
F2-41-4691-5 |
| Synonyms |
(8S,9S,11R,13S,14S,17R)-11-ethenyl-17-[(E)-2-iodoethenyl]-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-[(E)-2-iodovinyl]-13-methyl-11-vinyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
| Wiley ID |
1599896 |
![(8S,9S,11R,13S,14S,17R)-11-ethenyl-17-[(E)-2-iodanylethenyl]-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol](/api/spectrum/ELZrGJ4HZkR/structure.png?h=300&w=458 "(8S,9S,11R,13S,14S,17R)-11-ethenyl-17-[(E)-2-iodanylethenyl]-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol")
