Vitas-M small molecule compound
7,16-dihydroxy-6,7,8,9,16,17-hexahydro-5H,15H-14,9:18,5-di(metheno)dibenzo[b,i][1,4,8,11]tetraazacyclotetradecine-5,9-diium
Catalog ID
STL327194
SMILES OC1Cn2c[n+](c3c2cccc3)CC(C[n+]2cn(C1)c1ccccc21)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H22N4O2 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2/c25-15-9-21-13-22(18-6-2-1-5-17(18)21)10-16(26)12-24-14-23(11-15)19-7-3-4-8-20(19)24/h1-8,13-16,25-26H,9-12H2/q+2InChIKey
WDTVGQMDNSMBMR-UHFFFAOYSA-NSynonyms
314dihydroxy1$l^(5)5$l^(5)1216tetraazapentacyclo(14611^(512)0^(611)0^(1722))tetracosa1(23)5(24)6(11)7917(22)1820octaene15bis(ylium)dichloride
716dihydroxy67891617hexahydro5H15H149185di(metheno)dibenzo(bi)(14811)tetraazacyclotetradecine59diium
C1C(CN2C=(N+)(CC(C(N+)3=CN1C4=CC=CC=C43)O)C5=CC=CC=C52)O
InChI=1SC20H22N4O2c25159211322(18621517(18)21)1016(26)12241423(1115)19734820(19)24h1813162526H912H2q+2
MFCD01880664
OC1Cn2c(n+)(c3c2cccc3)CC(C(n+)2cn(C1)c1ccccc21)O
OC1Cn2c(n+)(c3c2cccc3)CC(C(n+)2cn(C1)c1ccccc21)O(Cl)(Cl)
ZINC000001294041
ZINC01294041
ZINC1294041
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