Vitas-M small molecule compound
trimethyl 5,5',5''-benzene-1,3,5-triyltris(3-phenyl-1,2-oxazole-4-carboxylate)
Catalog ID
STL442422
SMILES COC(=O)c1c(onc1c1ccccc1)c1cc(cc(c1)c1onc(c1C(=O)OC)c1ccccc1)c1onc(c1C(=O)OC)c1ccccc1
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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 C39H27N3O9 MW 681.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H27N3O9/c1-46-37(43)28-31(22-13-7-4-8-14-22)40-49-34(28)25-19-26(35-29(38(44)47-2)32(41-50-35)23-15-9-5-10-16-23)21-27(20-25)36-30(39(45)48-3)33(42-51-36)24-17-11-6-12-18-24/h4-21H,1-3H3InChIKey
UNTJQFJLHDCWTJ-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(ON=C1C2=CC=CC=C2)C3=CC(=CC(=C3)C4=C(C(=NO4)C5=CC=CC=C5)C(=O)OC)C6=C(C(=NO6)C7=CC=CC=C7)C(=O)OC
InChI=1SC39H27N3O9c14637(43)2831(22137481422)404934(28)251926(3529(38(44)472)32(415035)231595101623)2127(2025)3630(39(45)483)33(425136)2417116121824h421H13H3
methyl5(35bis(4methoxycarbonyl3phenyl12oxazol5yl)phenyl)3phenyl12oxazole4carboxylate
MFCD29709935
trimethyl555benzene135triyltris(3phenyl12oxazole4carboxylate)
ZINC000097957336
ZINC97957336
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