Vitas-M small molecule compound

methyl 4-[({4,7-dimethyl-5-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}acetyl)amino]benzoate

Catalog ID
STL010055
SMILES COC(=O)c1ccc(cc1)NC(=O)Cc1c(=O)oc2c(c1C)c(OCC(=C)C)cc(c2)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)13-31-20-10-15(3)11-21-23(20)16(4)19(25(29)32-21)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
MBDIQJZDFSCJIT-UHFFFAOYSA-N
Synonyms
919742-17-9
919742179
CC1=CC2=C(C(=C(C(=O)O2)CC(=O)NC3=CC=C(C=C3)C(=O)OC)C)C(=C1)OCC(=C)C
InChI=1SC25H25NO6c114(2)1331201015(3)112123(20)16(4)19(25(29)3221)1222(27)26188617(7918)24(28)305h611H11213H225H3(H2627)
METHYL4(((47DIMETHYL5((2METHYLPROP2EN1YL)OXY)2OXO2HCHROMEN3YL)ACETYL)AMINO)BENZOATE
methyl4((2(47dimethyl5(2methylprop2enoxy)2oxochromen3yl)acetyl)amino)benzoate
methyl4(2(47dimethyl5((2methylallyl)oxy)2oxo2Hchromen3yl)acetamido)benzoate
MFCD08742306
ZINC000012893081
ZINC12893081

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Available files

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