Vitas-M small molecule compound
4-ethyl-8-{[(3-methylphenyl)ammonio]methyl}-2-oxo-2H-chromen-7-olate
Catalog ID
STK630774
SMILES CCc1cc(=O)oc2c1ccc(c2C[NH2+]c1cccc(c1)C)[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 C19H19NO3 MW 309.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO3/c1-3-13-10-18(22)23-19-15(13)7-8-17(21)16(19)11-20-14-6-4-5-12(2)9-14/h4-10,20-21H,3,11H2,1-2H3InChIKey
UJZHZLUPWCTTNU-UHFFFAOYSA-NSynonyms
4ethyl7hydroxy8((3methylanilino)methyl)chromen2one
4ethyl8(((3methylphenyl)ammonio)methyl)2oxo2Hchromen7olate
CCC1=CC(=O)OC2=C1C=CC(=C2CNC3=CC=CC(=C3)C)O
CCc1cc(=O)oc2c1ccc(c2C(NH2+)c1cccc(c1)C)(O)
InChI=1SC19H19NO3c13131018(22)231915(13)7817(21)16(19)11201464512(2)914h4102021H311H212H3
MFCD08747670
ZINC000009306442
ZINC09306442
ZINC9306442
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