| SpectraBase Spectrum ID |
CxzJhFUxWiE |
| Name |
(4R,5S,8S,9S,10R,13R,14S,17R)-4-bromanyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| Alternate Name(s) |
(4R,5S,8S,9S,10R,13R,14S,17R)-4-bromo-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
(4R,5S,8S,9S,10R,13R,14S,17R)-4-bromo-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H43BrO |
| InChI |
InChI=1S/C27H43BrO/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(28)24(29)14-16-27(23,5)22(19)13-15-26(20,21)4/h14,16-23,25H,6-13,15H2,1-5H3/t18-,19+,20-,21+,22+,23-,25-,26-,27-/m1/s1 |
| InChIKey |
CJUWSVXJLBPILS-BAWZUTTFSA-N |
| Molecular Weight |
463.544 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@@]2([C@@](Br)(C(C=C1)=O)[H])[H])[H])C |
| SPLASH |
splash10-00di-0903100000-fde49be8ad29de786ab8 |
| Source of Spectrum |
KC-1992-3107-0 |
| Wiley ID |
777382 |
![(4R,5S,8S,9S,10R,13R,14S,17R)-4-bromanyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one](/api/spectrum/CxzJhFUxWiE/structure.png?h=300&w=458 "(4R,5S,8S,9S,10R,13R,14S,17R)-4-bromanyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one")
