Vitas-M small molecule compound

3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-chromen-6-yl propanoate

Catalog ID
STL033580
SMILES CCC(=O)Oc1ccc2c(c1)c(C)c(c(=O)o2)c1ccc(c(c1)OC)OC

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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 C21H20O6 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O6/c1-5-19(22)26-14-7-9-16-15(11-14)12(2)20(21(23)27-16)13-6-8-17(24-3)18(10-13)25-4/h6-11H,5H2,1-4H3
InChIKey
XNWDQQHWPUNYGW-UHFFFAOYSA-N
Synonyms

(3(34DIMETHOXYPHENYL)4METHYL2OXOCHROMEN6YL)PROPANOATE
3(34dimethoxyphenyl)4methyl2oxo2Hchromen6ylpropanoate
3(34DIMETHOXYPHENYL)4METHYL2OXOCHROMEN6YLPROPANOATE
CCC(=O)OC1=CC2=C(C=C1)OC(=O)C(=C2C)C3=CC(=C(C=C3)OC)OC
InChI=1SC21H20O6c1519(22)2614791615(1114)12(2)20(21(23)2716)136817(243)18(1013)254h611H5H214H3
MFCD05940408
ZINC000004340701
ZINC04340701
ZINC4340701

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.