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- 4 of 12 defined stereocentres
(1alpha,5xi,9xi,10xi,13xi,16beta,17xi)-20-Ethyl-8-hydroxy-1,16-dimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate
O=C(OC4C2[C@@]3(O)C6C1N(CC)C[C@]5(C([C@]1(C2CC4[C@@H](OC)C3)C(OC)CC5)C6)COC)c7ccccc7
InChI=1S/C31H43NO6/c1-5-32-16-29(17-35-2)12-11-24(37-4)31-20-13-19-22(36-3)15-30(34,21(27(31)32)14-23(29)31)25(20)26(19)38-28(33)18-9-7-6-8-10-18/h6-10,19-27,34H,5,11-17H2,1-4H3/t19?,20?,21?,22-,23?,24?,25?,26?,27?,29-,30-,31+/m0/s1
NDYOWPIMXBSPHT-XPPVMHGVSA-N
CSID:8567554, http://www.chemspider.com/Chemical-Structure.8567554.html (accessed 10:12, Apr 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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