Try beta.chemspider
- 8 of 13 defined stereocentres
(1alpha,5xi,6alpha,9xi,10alpha,14alpha,16beta,17xi)-20-Ethyl-13-hydroxy-1,6,16-trimethoxy-14-(4-methoxybenzoyl)-4-(methoxymethyl)aconitan-8-yl acetate
O=C(c1ccc(OC)cc1)[C@H]7[C@]5(O)CC6[C@@]42[C@@H](OC)CC[C@@]3(C2[C@@H](OC)C(C4N(CC)C3)[C@@](OC(=O)C)(C[C@@H]5OC)C67)COC
InChI=1S/C35H49NO9/c1-8-36-17-32(18-40-3)14-13-23(42-5)35-22-15-33(39)24(43-6)16-34(45-19(2)37,27(31(35)36)29(44-7)30(32)35)25(22)26(33)28(38)20-9-11-21(41-4)12-10-20/h9-12,22-27,29-31,39H,8,13-18H2,1-7H3/t22?,23-,24-,25?,26-,27?,29-,30?,31?,32-,33-,34+,35-/m0/s1
YRECILNLFWZVRM-SCIDOCSRSA-N
CSID:8207482, http://www.chemspider.com/Chemical-Structure.8207482.html (accessed 06:33, Jun 1, 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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