- 2 of 2 defined stereocentres
(17S,20R)-20-[(Benzylsulfonyl)amino]-N-(4-carbamimidoylbenzyl)-3,10,19-trioxo-2,5,8,11,18-pentaazatetracyclo[20.2.2.2~5,8~.2~12,15~]triaconta-1(24),12,14,22,25,27-hexaene-17-carboxamide trifluoroaceta te (1:1)
c1ccc(cc1)CS(=O)(=O)N[C@@H]2Cc3ccc(cc3)NC(=O)CN4CCN(CC4)CC(=O)Nc5ccc(cc5)C[C@H](NC2=O)C(=O)NCc6ccc(cc6)C(=N)N.C(=O)(C(F)(F)F)O
InChI=1S/C41H47N9O6S.C2HF3O2/c42-39(43)32-12-6-30(7-13-32)24-44-40(53)35-22-28-8-14-33(15-9-28)45-37(51)25-49-18-20-50(21-19-49)26-38(52)46-34-16-10-29(11-17-34)23-36(41(54)47-35)48-57(55,56)27-31-4-2-1-3-5-31;3-2(4,5)1(6)7/h1-17,35-36,48H,18-27H2,(H3,42,43)(H,44,53)(H,45,51)(H,46,52)(H,47,54);(H,6,7)/t35-,36+;/m0./s1
WMLLWXCYJMFXSU-LTJSBYPUSA-N
CSID:29395355, http://www.chemspider.com/Chemical-Structure.29395355.html (accessed 00:58, Mar 29, 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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