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- 7 of 7 defined stereocentres
(3S,6S,9R,12S,15S,23S)-6-(3-Carbamimidamidopropyl)-12-(1H-imidazol-4-ylmethyl)-3-(1H-indol-3-ylmethyl)-9-(2-naphthylmethyl)-15-(L-norleucylamino)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexaazacyclotric osane-23-carboxamide
CCCC[C@@H](C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)Cc2cnc[nH]2)Cc3ccc4ccccc4c3)CCCNC(=N)N)Cc5c[nH]c6c5cccc6)C(=O)N)N
InChI=1S/C52H69N15O8/c1-2-3-14-36(53)46(70)64-43-26-44(68)58-20-9-8-16-38(45(54)69)62-49(73)41(24-33-27-60-37-15-7-6-13-35(33)37)66-47(71)39(17-10-21-59-52(55)56)63-48(72)40(23-30-18-19-31-11-4-5-12-32(31)22-30)65-50(74)42(67-51(43)75)25-34-28-57-29-61-34/h4-7,11-13,15,18-19,22,27-29,36,38-43,60H,2-3,8-10,14,16-17,20-21,23-26,53H2,1H3,(H2,54,69)(H,57,61)(H,58,68)(H,62,73)(H,63,72)(H,64,70)(H,65,74)(H,66,71)(H,67,75)(H4,55,56,59)/t36-,38-,39-,40+,41-,42-,43-/m0/s1
ZPANOUCVWZTSLE-VIONFHLBSA-N
CSID:23293638, http://www.chemspider.com/Chemical-Structure.23293638.html (accessed 00:27, May 19, 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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