Vitas-M small molecule compound

diethyl 4-hydroxy-2-(3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate

Catalog ID
STK373224
SMILES CCOC(=O)C1C(=O)CC(C(C1c1cccc(c1)OC)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 C20H26O7 MW 378.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26O7/c1-5-26-18(22)16-14(21)11-20(3,24)17(19(23)27-6-2)15(16)12-8-7-9-13(10-12)25-4/h7-10,15-17,24H,5-6,11H2,1-4H3
InChIKey
JCWWYVLGFJQWIC-UHFFFAOYSA-N
Synonyms
356784-08-2
356784082
4HYDROXY2(3METHOXYPHENYL)4METHYL6OXOCYCLOHEXANE13DICARBOXYLICACID
CCOC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC)C2=CC(=CC=C2)OC
diethyl4hydroxy2(3methoxyphenyl)4methyl6oxocyclohexane13dicarboxylate
ETHYL5(ETHOXYCARBONYL)2HYDROXY6(3METHOXYPHENYL)2METHYL4OXOCYCLOHEXANECARBOXYLATE
InChI=1SC20H26O7c152618(22)1614(21)1120(324)17(19(23)2762)15(16)1287913(1012)254h710151724H5611H214H3
MFCD00718102
ZINC000004099564
ZINC000013154927

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Available files

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