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- 5 of 5 defined stereocentres
(9S,10S,10aR)-9-Bromo-10-{2-[(1R,3S)-3-bromo-2,2-dimethyl-6-methylenecyclohexyl]ethyl}-10-methyl-7,8,9,10,10a,11-hexahydrodibenzo[b,e]oxepine-2-carboxylic acid
C[C@]1([C@H](CCC2=COc3ccc(cc3C[C@H]21)C(=O)O)Br)CC[C@@H]4C(=C)CC[C@@H](C4(C)C)Br
InChI=1S/C27H34Br2O3/c1-16-5-9-23(28)26(2,3)20(16)11-12-27(4)21-14-19-13-17(25(30)31)6-8-22(19)32-15-18(21)7-10-24(27)29/h6,8,13,15,20-21,23-24H,1,5,7,9-12,14H2,2-4H3,(H,30,31)/t20-,21-,23+,24+,27+/m1/s1
PSYSMHVCBGMCIW-FBHGCBBZSA-N
CSID:27023091, http://www.chemspider.com/Chemical-Structure.27023091.html (accessed 10:26, Jun 30, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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