Vitas-M small molecule compound

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

Catalog ID
STK841981
SMILES CC(OC(=O)C1C(=O)CC(C(C1c1cccnc1)C(=O)OC(C)C)(C)O)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 C20H27NO6 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO6/c1-11(2)26-18(23)16-14(22)9-20(5,25)17(19(24)27-12(3)4)15(16)13-7-6-8-21-10-13/h6-8,10-12,15-17,25H,9H2,1-5H3
InChIKey
OYCVZZUSJGVKGK-UHFFFAOYSA-N
Synonyms
1005054-18-1
1005054181
4HYDROXY4METHYL6OXO2(3PYRIDINYL)CYCLOHEXANE13DICARBOXYLICACIDDIPROPAN2YLESTER
4HYDROXY4METHYL6OXO2PYRIDIN3YLCYCLOHEXANE13DICARBOXYLICACIDDIISOPROPYLESTER
4HYDROXY6KETO4METHYL2(3PYRIDYL)CYCLOHEXANE13DICARBOXYLICACIDDIISOPROPYLESTER
CC(C)OC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OC(C)C)C2=CN=CC=C2
DIISOPROPYL4HYDROXY4METHYL6OXO2(3PYRIDINYL)13CYCLOHEXANEDICARBOXYLATE
diisopropyl4hydroxy4methyl6oxo2(pyridin3yl)cyclohexane13dicarboxylate
dipropan2yl4hydroxy4methyl6oxo2(pyridin3yl)cyclohexane13dicarboxylate
DIPROPAN2YL4HYDROXY4METHYL6OXO2PYRIDIN3YLCYCLOHEXANE13DICARBOXYLATE
DIPROPAN2YL4METHYL4OXIDANYL6OXIDANYLIDENE2PYRIDIN3YLCYCLOHEXANE13DICARBOXYLATE
InChI=1SC20H27NO6c111(2)2618(23)1614(22)920(525)17(19(24)2712(3)4)15(16)13768211013h681012151725H9H215H3
MFCD02049839
ZINC000000864383
ZINC000013116499

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Available files

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