| SpectraBase Spectrum ID |
Hr8Q6dg8Fyk |
| Name |
(13S,16S,17S)-16-(3-bromopropyl)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
| Alternate Name(s) |
3-[3',17'.beta.-Dihydroxy-1',3',5'(10')-estratrien-16'-.beta.-yl]-bromopropane
3-[3,17.beta.-dihydroxy-1,3,5(10)-estratrien-16-.beta.-yl]-bromopropane
(13S,16S,17S)-16-(3-bromanylpropyl)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29BrO2 |
| InChI |
InChI=1S/C21H29BrO2/c1-21-9-8-17-16-7-5-15(23)11-13(16)4-6-18(17)19(21)12-14(20(21)24)3-2-10-22/h5,7,11,14,17-20,23-24H,2-4,6,8-10,12H2,1H3/t14-,17?,18?,19?,20-,21-/m0/s1 |
| InChIKey |
NKYWUIDJPNFZAP-CMNURJFISA-N |
| Molecular Weight |
393.365 g/mol |
| SMILES |
Oc1ccc2c(CCC3C4[C@@]([C@]([C@](C4)(CCCBr)[H])(O)[H])(CCC23)C)c1 |
| SPLASH |
splash10-03dj-8039000000-9d51968563924e3f1632 |
| Source of Spectrum |
G2-3-516-14b |
| Wiley ID |
1661468 |
![(13S,16S,17S)-16-(3-bromopropyl)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol](/api/spectrum/Hr8Q6dg8Fyk/structure.png?h=300&w=458 "(13S,16S,17S)-16-(3-bromopropyl)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol")
