Try beta.chemspider
- 6 of 6 defined stereocentres
(2'beta,5'beta,8alpha,11'alpha,12'beta)-12'-Hydroxy-2',5'-diisopropyl-3',6',18-trioxoergotaman
O=C3N1CCC[C@@H]1[C@@]2(O)O[C@@](C(=O)N2[C@@H]3C(C)C)(NC(=O)[C@H]7/C=C6/c4cccc5c4c(cn5)C[C@H]6N(C)C7)C(C)C
InChI=1S/C31H39N5O5/c1-16(2)26-28(38)35-11-7-10-24(35)31(40)36(26)29(39)30(41-31,17(3)4)33-27(37)19-12-21-20-8-6-9-22-25(20)18(14-32-22)13-23(21)34(5)15-19/h6,8-9,12,14,16-17,19,23-24,26,32,40H,7,10-11,13,15H2,1-5H3,(H,33,37)/t19-,23+,24+,26+,30-,31+/m0/s1
UJYGDMFEEDNVBF-VVDHEXQNSA-N
CSID:5422626, http://www.chemspider.com/Chemical-Structure.5422626.html (accessed 20:34, May 5, 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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