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- 4 of 5 defined stereocentres
({(2S)-1-[(2S)-2-(4-{(6S)-3-[2-(1-{(2S)-2-[(Carboxymethyl)amino]-3-methylbutanoyl}-2-pyrrolidinyl)-1H-imidazol-4-yl]-6-phenylindolo[1,2-c][1,3]benzoxazin-9-yl}-1H-imidazol-2-yl)-1-pyrrolidinyl]-3-meth yl-1-oxo-2-butanyl}amino)acetic acid (non-preferred name)
CC(C)[C@@H](C(=O)N1CCC[C@H]1c2[nH]cc(n2)c3ccc4cc-5n(c4c3)[C@@H](Oc6c5ccc(c6)c7c[nH]c(n7)C8CCCN8C(=O)[C@H](C(C)C)NCC(=O)O)c9ccccc9)NCC(=O)O
InChI=1S/C49H55N9O7/c1-27(2)43(50-25-41(59)60)47(63)56-18-8-12-36(56)45-52-23-34(54-45)30-14-15-32-21-39-33-17-16-31(22-40(33)65-49(58(39)38(32)20-30)29-10-6-5-7-11-29)35-24-53-46(55-35)37-13-9-19-57(37)48(64)44(28(3)4)51-26-42(61)62/h5-7,10-11,14-17,20-24,27-28,36-37,43-44,49-51H,8-9,12-13,18-19,25-26H2,1-4H3,(H,52,54)(H,53,55)(H,59,60)(H,61,62)/t36-,37?,43-,44-,49-/m0/s1
TWJSLXLCNDNBLX-YHLWRMOISA-N
CSID:34537818, http://www.chemspider.com/Chemical-Structure.34537818.html (accessed 23:25, Apr 25, 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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