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- 3 of 3 defined stereocentres
Benzyl {(2S)-5-[(diaminomethylene)amino]-1-[(4-{(2S,5S)-5-[4-({4-[(diaminomethylene)amino]butanoyl}amino)butyl]-3,6-dioxo-2-piperazinyl}butyl)amino]-1-oxo-2-pentanyl}carbamate
C1=CC=C(C=C1)COC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCCCC[C@H]2C(=O)N[C@H](C(=O)N2)CCCCNC(=O)CCCNC(=N)N
InChI=1S/C31H51N11O6/c32-29(33)38-18-8-14-22(42-31(47)48-20-21-10-2-1-3-11-21)26(44)37-17-7-5-13-24-28(46)40-23(27(45)41-24)12-4-6-16-36-25(43)15-9-19-39-30(34)35/h1-3,10-11,22-24H,4-9,12-20H2,(H,36,43)(H,37,44)(H,40,46)(H,41,45)(H,42,47)(H4,32,33,38)(H4,34,35,39)/t22-,23-,24-/m0/s1
JXUVCTUDBUXEQU-HJOGWXRNSA-N
CSID:9437434, http://www.chemspider.com/Chemical-Structure.9437434.html (accessed 05:33, 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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