Vitas-M small molecule compound

methyl 2-{[3-(2,5-dimethoxyphenyl)-4-methyl-2-oxo-2H-chromen-6-yl]oxy}propanoate

Catalog ID
STL034099
SMILES COC(=O)C(Oc1ccc2c(c1)c(C)c(c(=O)o2)c1cc(OC)ccc1OC)C

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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 C22H22O7 MW 398.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O7/c1-12-16-11-15(28-13(2)21(23)27-5)7-9-19(16)29-22(24)20(12)17-10-14(25-3)6-8-18(17)26-4/h6-11,13H,1-5H3
InChIKey
CMTDJPKTGMCUMX-UHFFFAOYSA-N
Synonyms
864819-22-7
864819227
CC1=C(C(=O)OC2=C1C=C(C=C2)OC(C)C(=O)OC)C3=C(C=CC(=C3)OC)OC
InChI=1SC22H22O7c112161115(2813(2)21(23)275)7919(16)2922(24)20(12)171014(253)6818(17)264h61113H15H3
methyl2((3(25dimethoxyphenyl)4methyl2oxo2Hchromen6yl)oxy)propanoate
METHYL2(3(25DIMETHOXYPHENYL)4METHYL2OXOCHROMEN6YL)OXYPROPANOATE
METHYL2(3(25DIMETHOXYPHENYL)4METHYL2OXOCHROMEN6YLOXY)PROPANOATE
MFCD06769200
ZINC000004088990
ZINC000004088995

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Available files

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