| SpectraBase Spectrum ID |
8vBnoe1UiMZ |
| Name |
(8S,9S,13S,14S,17S)-1-bromanyl-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol |
| Alternate Name(s) |
(8S,9S,13S,14S,17S)-1-bromo-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol |
| CAS Registry Number |
20146-91-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H25BrO2 |
| InChI |
InChI=1S/C19H25BrO2/c1-19-8-7-14-13(15(19)5-6-17(19)21)4-3-11-9-12(22-2)10-16(20)18(11)14/h9-10,13-15,17,21H,3-8H2,1-2H3/t13-,14+,15+,17+,19+/m1/s1 |
| InChIKey |
JTJUSGSUTBMPAP-BTWZCHHXSA-N |
| Molecular Weight |
365.311 g/mol |
| SMILES |
O[C@@]1([C@]2(CC[C@@]3(c4c(cc(cc4CC[C@]3([C@@]2(CC1)[H])[H])OC)Br)[H])C)[H] |
| SPLASH |
splash10-02t9-0009000000-75c0d1b0effbb6b516db |
| Source of Spectrum |
J-49-2745-0 |
| Wiley ID |
1350715 |
![(8S,9S,13S,14S,17S)-1-bromanyl-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol](/api/spectrum/8vBnoe1UiMZ/structure.png?h=300&w=458 "(8S,9S,13S,14S,17S)-1-bromanyl-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol")
