Vitas-M small molecule compound
4-({[2-(2,2-dimethyl-4-phenyltetrahydro-2H-pyran-4-yl)ethyl]ammonio}methyl)-2-methoxyphenolate
Catalog ID
STL528573
SMILES COc1cc(C[NH2+]CCC2(CCOC(C2)(C)C)c2ccccc2)ccc1[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 C23H31NO3 MW 369.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31NO3/c1-22(2)17-23(12-14-27-22,19-7-5-4-6-8-19)11-13-24-16-18-9-10-20(25)21(15-18)26-3/h4-10,15,24-25H,11-14,16-17H2,1-3H3InChIKey
BTRKQQZHDJJSEA-UHFFFAOYSA-NSynonyms
126318-08-9126318089
4(((2(22dimethyl4phenyltetrahydro2Hpyran4yl)ethyl)ammonio)methyl)2methoxyphenolate
4((2(22DIMETHYL4PHENYLOXAN4YL)ETHYLAZANIUMYL)METHYL)2METHOXYPHENOLATE
5146053
InChI=1SC23H31NO3c122(2)1723(12142722197546819)111324161891020(25)21(1518)263h410152425H11141617H213H3
MFCD00295695
ZINC000004026777
ZINC000004026778
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