Vitas-M small molecule compound

methyl 3-[3-(difluoromethoxy)phenyl]-3-(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)propanoate

Catalog ID
STL566743
SMILES COC(=O)CC(c1c(O)cc(c2c1oc(cc2=O)c1ccccc1)O)c1cccc(c1)OC(F)F

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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 C26H20F2O7 MW 482.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20F2O7/c1-33-22(32)11-17(15-8-5-9-16(10-15)34-26(27)28)23-18(29)12-19(30)24-20(31)13-21(35-25(23)24)14-6-3-2-4-7-14/h2-10,12-13,17,26,29-30H,11H2,1H3
InChIKey
SEXWTSNMPINUOU-UHFFFAOYSA-N
Synonyms
1574517-50-2
1574517502
71828248
InChI=1SC26H20F2O7c13322(32)1117(1585916(1015)3426(27)28)2318(29)1219(30)2420(31)1321(3525(23)24)146324714h210121317262930H11H21H3
methyl3(3(difluoromethoxy)phenyl)3(57dihydroxy4oxo2phenyl4Hchromen8yl)propanoate
methyl3(3(difluoromethoxy)phenyl)3(57dihydroxy4oxo2phenylchromen8yl)propanoate
MFCD28057135
ZINC000096118168
ZINC000096118169

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Available files

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