Try beta.chemspider
- 5 of 6 defined stereocentres
(5'alpha,8xi,11'alpha)-2'-Ethyl-12'-hydroxy-5'-methyl-3',6',18-trioxo-5'-phenylergotaman
CC[C@@]1(C(=O)N2[C@@](C(=O)N3CCC[C@@H]3[C@@]2(O1)O)(C)c4ccccc4)NC(=O)C5CN([C@@H]6Cc7c[nH]c8c7c(ccc8)C6=C5)C
InChI=1S/C34H37N5O5/c1-4-33(36-29(40)21-16-24-23-12-8-13-25-28(23)20(18-35-25)17-26(24)37(3)19-21)31(42)39-32(2,22-10-6-5-7-11-22)30(41)38-15-9-14-27(38)34(39,43)44-33/h5-8,10-13,16,18,21,26-27,35,43H,4,9,14-15,17,19H2,1-3H3,(H,36,40)/t21?,26-,27-,32+,33-,34+/m1/s1
QBIXIEJSLOJATM-ZQYQIBHZSA-N
CSID:2340950, http://www.chemspider.com/Chemical-Structure.2340950.html (accessed 03:02, May 6, 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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