Try beta.chemspider
- 8 of 8 defined stereocentres
(5'alpha,10alpha)-5'-[(2R)-2-Butanyl]-12'-hydroxy-2'-isopropyl-3',18-dioxo-9,10-dihydroergotaman
CC[C@@H](C)[C@H]1CN2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@@H]4C[C@@H]5c6cccc7c6c(c[nH]7)C[C@H]5N(C4)C)O
InChI=1S/C32H45N5O4/c1-6-19(4)26-17-36-12-8-11-27(36)32(40)37(26)30(39)31(41-32,18(2)3)34-29(38)21-13-23-22-9-7-10-24-28(22)20(15-33-24)14-25(23)35(5)16-21/h7,9-10,15,18-19,21,23,25-27,33,40H,6,8,11-14,16-17H2,1-5H3,(H,34,38)/t19-,21-,23-,25-,26-,27+,31-,32+/m1/s1
OPAVODIYXVLOOM-KIDRBZCDSA-N
CSID:32697953, http://www.chemspider.com/Chemical-Structure.32697953.html (accessed 21:16, May 21, 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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