- 3 of 3 defined stereocentres
N-[(2S,13S)-2-{4-[(2-Methyl-2-propanyl)oxy]benzyl}-3,7,14-trioxo-1,4,8-triazacyclotetradecan-13-yl]-L-phenylalaninamide
O=C1NCCCC[C@@H](C(=O)N[C@H](C(=O)NCC1)Cc2ccc(OC(C)(C)C)cc2)NC(=O)[C@@H](N)Cc3ccccc3
InChI=1S/C31H43N5O5/c1-31(2,3)41-23-14-12-22(13-15-23)20-26-29(39)34-18-16-27(37)33-17-8-7-11-25(30(40)36-26)35-28(38)24(32)19-21-9-5-4-6-10-21/h4-6,9-10,12-15,24-26H,7-8,11,16-20,32H2,1-3H3,(H,33,37)(H,34,39)(H,35,38)(H,36,40)/t24-,25-,26-/m0/s1
IVBGSMWJTGJTBC-GSDHBNRESA-N
CSID:9050729, http://www.chemspider.com/Chemical-Structure.9050729.html (accessed 19:43, Apr 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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