Vitas-M small molecule compound

diethyl 4-hydroxy-4-methyl-6-oxo-2-(pyridin-3-yl)cyclohexane-1,3-dicarboxylate

Catalog ID
STK327354
SMILES CCOC(=O)C1C(=O)CC(C(C1c1cccnc1)C(=O)OCC)(C)O

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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 C18H23NO6 MW 349.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO6/c1-4-24-16(21)14-12(20)9-18(3,23)15(17(22)25-5-2)13(14)11-7-6-8-19-10-11/h6-8,10,13-15,23H,4-5,9H2,1-3H3
InChIKey
OZEKMLJYTCPRAI-UHFFFAOYSA-N
Synonyms
1212343-65-1
1212343651
CCOC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC)C2=CN=CC=C2
diethyl4hydroxy4methyl6oxo2(pyridin3yl)cyclohexane13dicarboxylate
DIETHYL4HYDROXY4METHYL6OXO2PYRIDIN3YLCYCLOHEXANE13DICARBOXYLATE
InChI=1SC18H23NO6c142416(21)1412(20)918(323)15(17(22)2552)13(14)11768191011h6810131523H459H213H3
MFCD02029118
ZINC000000074304
ZINC000012661334

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Available files

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