Vitas-M small molecule compound
methyl 4-[({[6-(azepan-1-ylmethyl)-4-oxo-4H-pyran-3-yl]oxy}acetyl)amino]benzoate
Catalog ID
STL319156
SMILES COC(=O)c1ccc(cc1)NC(=O)COc1coc(cc1=O)CN1CCCCCC1
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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 C22H26N2O6 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O6/c1-28-22(27)16-6-8-17(9-7-16)23-21(26)15-30-20-14-29-18(12-19(20)25)13-24-10-4-2-3-5-11-24/h6-9,12,14H,2-5,10-11,13,15H2,1H3,(H,23,26)InChIKey
MENMGOOQXUSNNB-UHFFFAOYSA-NSynonyms
1401602-57-01401602570
COC(=O)C1=CC=C(C=C1)NC(=O)COC2=COC(=CC2=O)CN3CCCCCC3
InChI=1SC22H26N2O6c12822(27)166817(9716)2321(26)153020142918(1219(20)25)13241042351124h691214H2510111315H21H3(H2326)
methyl4((((6(azepan1ylmethyl)4oxo4Hpyran3yl)oxy)acetyl)amino)benzoate
methyl4((2(6(azepan1ylmethyl)4oxopyran3yl)oxyacetyl)amino)benzoate
methyl4(2((6(azepan1ylmethyl)4oxo4Hpyran3yl)oxy)acetamido)benzoate
MFCD22586230
ZINC000079501677
ZINC79501677
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