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- 3 of 3 defined stereocentres
- Non-standard isotope
(~2~H_5_)Phenylmethyl {[(8beta)-1,6-dimethylergolin-8-yl]methyl}carbamate
CN1C[C@@H](C[C@@H]2C3=C4C(=CN(C)C4=CC=C3)C[C@H]21)CN=C(O)OCC5=C([2H])C([2H])=C([2H])C([2H])=C5[2H] [2H]c1c(c(c(c(c1[2H])[2H])COC(=O)NC[C@@H]2C[C@@H]3c4cccc5c4c(cn5C)C[C@H]3N(C2)C)[2H])[2H]
InChI=1S/C25H29N3O2/c1-27-14-18(13-26-25(29)30-16-17-7-4-3-5-8-17)11-21-20-9-6-10-22-24(20)19(12-23(21)27)15-28(22)2/h3-10,15,18,21,23H,11-14,16H2,1-2H3,(H,26,29)/t18-,21+,23+/m0/s1/i3D,4D,5D,7D,8D
WZHJKEUHNJHDLS-JOVUSLCDSA-N
CSID:58783388, http://www.chemspider.com/Chemical-Structure.58783388.html (accessed 18:54, Apr 23, 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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