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- 6 of 6 defined stereocentres
N~1~-{(2S,3R)-3-Hydroxy-4-[(3S,4aR,8aS)-3-[(2-methyl-2-propanyl)carbamoyl]octahydro-2(1H)-isoquinolinyl]-1-phenyl-2-butanyl}-N~4~-(2-quinolinylcarbonyl)-L-aspartamide
O=C(c1nc2c(cc1)cccc2)NC(=O)C[C@H](N)C(=O)N[C@@H](Cc3ccccc3)[C@H](O)CN5[C@H](C(=O)NC(C)(C)C)C[C@H]4CCCC[C@@H]4C5
InChI=1S/C38H50N6O5/c1-38(2,3)43-37(49)32-20-26-14-7-8-15-27(26)22-44(32)23-33(45)31(19-24-11-5-4-6-12-24)41-35(47)28(39)21-34(46)42-36(48)30-18-17-25-13-9-10-16-29(25)40-30/h4-6,9-13,16-18,26-28,31-33,45H,7-8,14-15,19-23,39H2,1-3H3,(H,41,47)(H,43,49)(H,42,46,48)/t26-,27-,28+,31+,32+,33-/m1/s1
KCGRLCGIJYMACR-NAWMAGHLSA-N
CSID:9225817, http://www.chemspider.com/Chemical-Structure.9225817.html (accessed 14:16, Apr 24, 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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