Try beta.chemspider
- 1 of 2 defined stereocentres
2-[(4-{2-Acetamido-3-[(5-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]amino}-5-oxopentyl)amino]-3-oxopropyl}-2-ethylphenyl)(carboxycarbonyl)amino]benzoic acid
CCC1=C(C=CC(=C1)CC(C(=O)NCCCCC(=O)N[C@@H](CCSC)C(=O)O)NC(=O)C)N(C2=CC=CC=C2C(=O)O)C(=O)C(=O)O
InChI=1S/C32H40N4O10S/c1-4-21-17-20(12-13-25(21)36(29(40)32(45)46)26-10-6-5-9-22(26)30(41)42)18-24(34-19(2)37)28(39)33-15-8-7-11-27(38)35-23(31(43)44)14-16-47-3/h5-6,9-10,12-13,17,23-24H,4,7-8,11,14-16,18H2,1-3H3,(H,33,39)(H,34,37)(H,35,38)(H,41,42)(H,43,44)(H,45,46)/t23-,24?/m0/s1
JYWLVKREVMTEJA-UXMRNZNESA-N
CSID:8230822, http://www.chemspider.com/Chemical-Structure.8230822.html (accessed 18:13, May 21, 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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