Try beta.chemspider
- 2 of 2 defined stereocentres
(18R,21S)-18-[(Benzylsulfonyl)amino]-N-(4-carbamimidoylbenzyl)-3,10,19-trioxo-2,5,8,11,20-pentaazatetracyclo[21.2.2.2~5,8~.2~13,16~]hentriaconta-1(25),13,15,23,26,28-hexaene-21-carboxamide trifluoroac etate (1:1)
c1ccc(cc1)CS(=O)(=O)N[C@@H]2Cc3ccc(cc3)CNC(=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/C42H49N9O6S.C2HF3O2/c43-40(44)34-14-10-32(11-15-34)25-46-41(54)36-22-30-12-16-35(17-13-30)47-39(53)27-51-20-18-50(19-21-51)26-38(52)45-24-31-8-6-29(7-9-31)23-37(42(55)48-36)49-58(56,57)28-33-4-2-1-3-5-33;3-2(4,5)1(6)7/h1-17,36-37,49H,18-28H2,(H3,43,44)(H,45,52)(H,46,54)(H,47,53)(H,48,55);(H,6,7)/t36-,37+;/m0./s1
AGWPISFQDMJINO-CZZGGHMTSA-N
CSID:29397716, http://www.chemspider.com/Chemical-Structure.29397716.html (accessed 12:39, Apr 26, 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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