Vitas-M small molecule compound

methyl {[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,6-diethyl-4-oxo-4H-chromen-7-yl]oxy}acetate

Catalog ID
STK857222
SMILES COC(=O)COc1cc2oc(CC)c(c(=O)c2cc1CC)c1ccc2c(c1)OCCO2

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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 C24H24O7 MW 424.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24O7/c1-4-14-10-16-20(12-19(14)30-13-22(25)27-3)31-17(5-2)23(24(16)26)15-6-7-18-21(11-15)29-9-8-28-18/h6-7,10-12H,4-5,8-9,13H2,1-3H3
InChIKey
QKLPUDVAOJFOMJ-UHFFFAOYSA-N
Synonyms
180077-41-2
180077412
CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)CC)C3=CC4=C(C=C3)OCCO4)OCC(=O)OC
InChI=1SC24H24O7c1414101620(1219(14)301322(25)273)3117(52)23(24(16)26)15671821(1115)29982818h671012H458913H213H3
methyl((3(23dihydro14benzodioxin6yl)26diethyl4oxo4Hchromen7yl)oxy)acetate
METHYL2((3(23DIHYDRO14BENZODIOXIN6YL)26DIETHYL4OXO4HCHROMEN7YL)OXY)ACETATE
METHYL2((3(23DIHYDROBENZO(B)(14)DIOXIN6YL)26DIETHYL4OXO4HCHROMEN7YL)OXY)ACETATE
METHYL2(3(23DIHYDRO14BENZODIOXIN6YL)26DIETHYL4OXOCHROMEN7YL)OXYACETATE
MFCD00709999
ZINC000000630476
ZINC00630476
ZINC630476

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Available files

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