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- 8 of 8 defined stereocentres
1-{[(4S,7S,10S,13S,16S)-7-(2-Amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-2-butanyl]-16-(4-methoxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}-L-prol yl-L-ornithylglycinamide
CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](CSSCCC(=O)N[C@H](C(=O)N1)Cc2ccc(cc2)OC)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N
InChI=1S/C43H66N12O12S2/c1-4-23(2)36-42(65)51-27(13-14-32(45)56)38(61)52-29(20-33(46)57)39(62)53-30(22-69-68-18-15-35(59)49-28(40(63)54-36)19-24-9-11-25(67-3)12-10-24)43(66)55-17-6-8-31(55)41(64)50-26(7-5-16-44)37(60)48-21-34(47)58/h9-12,23,26-31,36H,4-8,13-22,44H2,1-3H3,(H2,45,56)(H2,46,57)(H2,47,58)(H,48,60)(H,49,59)(H,50,64)(H,51,65)(H,52,61)(H,53,62)(H,54,63)/t23-,26-,27-,28-,29-,30+,31-,36-/m0/s1
RZHOHJYDUVWBHK-FAJKJHJLSA-N
CSID:23176403, http://www.chemspider.com/Chemical-Structure.23176403.html (accessed 16:07, Apr 26, 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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