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- 5 of 5 defined stereocentres
N-{[(3S)-2-(L-Tyrosyl)-1,2,3,4-tetrahydro-3-isoquinolinyl]carbonyl}-L-phenylalanyl-(betaS)-beta-methyl-L-phenylalaninamide
O=C(N)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@@H](N)Cc1ccc(O)cc1)Cc2ccccc2C3)Cc4ccccc4)[C@H](c5ccccc5)C
InChI=1S/C38H41N5O5/c1-24(27-12-6-3-7-13-27)34(35(40)45)42-36(46)32(21-25-10-4-2-5-11-25)41-37(47)33-22-28-14-8-9-15-29(28)23-43(33)38(48)31(39)20-26-16-18-30(44)19-17-26/h2-19,24,31-34,44H,20-23,39H2,1H3,(H2,40,45)(H,41,47)(H,42,46)/t24-,31-,32-,33-,34-/m0/s1
XYLFUNIJCNHESI-YIBKTFNBSA-N
CSID:8851070, http://www.chemspider.com/Chemical-Structure.8851070.html (accessed 15:42, Jul 6, 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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