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- 3 of 3 defined stereocentres
7-Ethyl-N-[(2S)-1-{[(2S,3S)-3-hydroxy-1-(isobutylamino)-1-oxo-2-hexanyl]amino}-3-phenyl-2-propanyl]-1-methyl-3,4-dihydro-1H-[1,2,5]thiadiazepino[3,4,5-hi]indole-9-carboxamide 2,2-dioxide
CCC[C@@H]([C@@H](C(=O)NCC(C)C)NC[C@H](Cc1ccccc1)NC(=O)c2cc3c(cn4c3c(c2)N(S(=O)(=O)CC4)C)CC)O
InChI=1S/C33H47N5O5S/c1-6-11-29(39)30(33(41)35-19-22(3)4)34-20-26(16-23-12-9-8-10-13-23)36-32(40)25-17-27-24(7-2)21-38-14-15-44(42,43)37(5)28(18-25)31(27)38/h8-10,12-13,17-18,21-22,26,29-30,34,39H,6-7,11,14-16,19-20H2,1-5H3,(H,35,41)(H,36,40)/t26-,29-,30-/m0/s1
LWOMHNWWEBISDH-NSGJQZOKSA-N
CSID:28668382, http://www.chemspider.com/Chemical-Structure.28668382.html (accessed 15:32, Jun 16, 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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