Try beta.chemspider
- 6 of 6 defined stereocentres
(5'beta,8alpha,12'beta)-2-Bromo-12'-hydroxy-5'-isobutyl-2'-isopropyl-3',6',18-trioxoergotaman
CN1C[C@H](C=C2[C@H]1CC1=C(Br)NC3=CC=CC2=C13)C(=O)N[C@@]1(O[C@]2(O)[C@@H]3CCCN3C(=O)[C@@H](CC(C)C)N2C1=O)C(C)C
InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23+,24+,25-,31+,32+/m0/s1
OZVBMTJYIDMWIL-DUPAAZSRSA-N
CSID:77498595, http://www.chemspider.com/Chemical-Structure.77498595.html (accessed 01:20, Apr 27, 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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