Vitas-M small molecule compound

methyl 4-[({4,8-dimethyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)amino]benzoate

Catalog ID
STL518081
SMILES COC(=O)c1ccc(cc1)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)OCC(=C)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 C25H25NO6 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO6/c1-14(2)13-31-21-11-10-19-15(3)20(25(29)32-23(19)16(21)4)12-22(27)26-18-8-6-17(7-9-18)24(28)30-5/h6-11H,1,12-13H2,2-5H3,(H,26,27)
InChIKey
HOQVWCJBHUUSKM-UHFFFAOYSA-N
Synonyms
919741-96-1
16407574
919741961
InChI=1SC25H25NO6c114(2)13312111101915(3)20(25(29)3223(19)16(21)4)1222(27)26188617(7918)24(28)305h611H11213H225H3(H2627)
methyl4(((48dimethyl7((2methylprop2en1yl)oxy)2oxo2Hchromen3yl)acetyl)amino)benzoate
methyl4((2(48dimethyl7(2methylprop2enoxy)2oxochromen3yl)acetyl)amino)benzoate
METHYL4(2(48DIMETHYL7((2METHYLALLYL)OXY)2OXO2HCHROMEN3YL)ACETAMIDO)BENZOATE
MFCD08741898
ZINC000008879155
ZINC8879155

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Available files

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