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- Double-bond stereo
- 2 of 2 defined stereocentres
[(8beta)-1-Isopropyl-6-methyl-9,10-didehydroergolin-8-yl]methanol (2Z)-2-butenedioate (1:1)
CC(C)n1cc2c3c1cccc3C4=C[C@H](CN([C@@H]4C2)C)CO.C(=C\C(=O)O)\C(=O)O
InChI=1S/C19H24N2O.C4H4O4/c1-12(2)21-10-14-8-18-16(7-13(11-22)9-20(18)3)15-5-4-6-17(21)19(14)15;5-3(6)1-2-4(7)8/h4-7,10,12-13,18,22H,8-9,11H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t13-,18-;/m1./s1
IIAPQWLHLDVEQN-UYFMFTGMSA-N
CSID:23230477, http://www.chemspider.com/Chemical-Structure.23230477.html (accessed 01:16, Apr 25, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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