- 1 of 2 defined stereocentres
Methyl 4-[(12aS)-2-(1-benzyl-4-piperidinyl)-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
COC(=O)c1ccc(cc1)C2c3c(c4ccccc4[nH]3)C[C@@H]5N2C(=O)CN(C5=O)C6CCN(CC6)Cc7ccccc7
InChI=1S/C34H34N4O4/c1-42-34(41)24-13-11-23(12-14-24)32-31-27(26-9-5-6-10-28(26)35-31)19-29-33(40)37(21-30(39)38(29)32)25-15-17-36(18-16-25)20-22-7-3-2-4-8-22/h2-14,25,29,32,35H,15-21H2,1H3/t29-,32?/m0/s1
KRQUULWGYFQOSS-QGFKTNLFSA-N
CSID:17470160, http://www.chemspider.com/Chemical-Structure.17470160.html (accessed 12:32, Mar 28, 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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