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- 13 of 14 defined stereocentres
(1alpha,3alpha,6alpha,11beta,14alpha,16beta,17S)-3,13-Dihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl 4-methoxybenzoate
COC[C@]12CN[C@H]3[C@@H]4[C@H](OC)[C@H]1C3([C@@H]1C[C@@]3(O)[C@H](OC(=O)C5C=CC(=CC=5)OC)[C@@H]1[C@@H]4C[C@@H]3OC)[C@H](C[C@H]2O)OC
InChI=1S/C31H43NO9/c1-36-14-29-13-32-26-23-17-10-20(38-3)30(35)12-18(31(26,25(29)24(23)40-5)21(39-4)11-19(29)33)22(17)27(30)41-28(34)15-6-8-16(37-2)9-7-15/h6-9,17-27,32-33,35H,10-14H2,1-5H3/t17-,18+,19+,20-,21-,22+,23-,24-,25+,26-,27+,29-,30-,31?/m0/s1
XISSUEXEHQIQCY-DUPZRXGYSA-N
CSID:95518981, http://www.chemspider.com/Chemical-Structure.95518981.html (accessed 09:41, Jun 12, 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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