Try beta.chemspider
- 5 of 14 defined stereocentres
(1beta,5xi,9xi,10xi,16beta,17xi)-8-Acetoxy-13,15-dihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)-20-methylaconitan-14-yl benzoate
CC(=O)O[C@]12C([C@@H]([C@]3(CC(C1C3OC(=O)c4ccccc4)C56[C@@H](CC[C@@]7(C5C(C2C6N(C7)C)OC)COC)OC)O)OC)O
InChI=1S/C33H45NO10/c1-17(35)44-33-21-19(14-31(38,28(42-6)26(33)36)27(21)43-29(37)18-10-8-7-9-11-18)32-20(40-4)12-13-30(16-39-3)15-34(2)25(32)22(33)23(41-5)24(30)32/h7-11,19-28,36,38H,12-16H2,1-6H3/t19?,20-,21?,22?,23?,24?,25?,26?,27?,28+,30+,31-,32?,33-/m1/s1
FIDOCHXHMJHKRW-AUGPMOESSA-N
CSID:4476981, http://www.chemspider.com/Chemical-Structure.4476981.html (accessed 11:15, Apr 23, 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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