- 2 of 2 defined stereocentres
(11S,14R)-14-[(Benzylsulfonyl)amino]-N-(4-carbamimidoylbenzyl)-4,13,21-trioxo-1,5,12,20,24-pentaazatetracyclo[22.3.2.2~6,9~.2~16,19~]tritriaconta-6,8,16,18,30,32-hexaene-11-carboxamide trifluoroacetat e (1:1)
c1ccc(cc1)CS(=O)(=O)N[C@@H]2Cc3ccc(cc3)NC(=O)CCN4CCCN(CCC(=O)Nc5ccc(cc5)C[C@H](NC2=O)C(=O)NCc6ccc(cc6)C(=N)N)CC4.C(=O)(C(F)(F)F)O
InChI=1S/C44H53N9O6S.C2HF3O2/c45-42(46)35-13-7-33(8-14-35)29-47-43(56)38-27-31-9-15-36(16-10-31)48-40(54)19-23-52-21-4-22-53(26-25-52)24-20-41(55)49-37-17-11-32(12-18-37)28-39(44(57)50-38)51-60(58,59)30-34-5-2-1-3-6-34;3-2(4,5)1(6)7/h1-3,5-18,38-39,51H,4,19-30H2,(H3,45,46)(H,47,56)(H,48,54)(H,49,55)(H,50,57);(H,6,7)/t38-,39+;/m0./s1
WZYRCJJNQVDXMC-MAVUKPMZSA-N
CSID:29398692, http://www.chemspider.com/Chemical-Structure.29398692.html (accessed 14:40, Mar 28, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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