Vitas-M small molecule compound

methyl 4-{[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoate

Catalog ID
STK829384
SMILES COC(=O)c1ccc(cc1)COc1ccc2c(c1C)oc(=O)c(c2C)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 C21H20O5 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O5/c1-12-13(2)20(22)26-19-14(3)18(10-9-17(12)19)25-11-15-5-7-16(8-6-15)21(23)24-4/h5-10H,11H2,1-4H3
InChIKey
ODNMWIRKOXWBTE-UHFFFAOYSA-N
Synonyms
374758-59-5
374758595
CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(C=C3)C(=O)OC)C
InChI=1SC21H20O5c11213(2)20(22)261914(3)18(10917(12)19)2511155716(8615)21(23)244h510H11H214H3
methyl4(((348trimethyl2oxo2Hchromen7yl)oxy)methyl)benzoate
METHYL4((348TRIMETHYL2OXOCHROMEN7YL)OXYMETHYL)BENZOATE
MFCD02058856
ZINC000004724343
ZINC04724343
ZINC4724343

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Available files

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