Vitas-M small molecule compound

ethyl 3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-4-methylpentanoate

Catalog ID
STL563014
SMILES CCOC(=O)CC(c1oc(CO)cc(=O)c1O)C(C)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 C14H20O6 MW 284.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20O6/c1-4-19-12(17)6-10(8(2)3)14-13(18)11(16)5-9(7-15)20-14/h5,8,10,15,18H,4,6-7H2,1-3H3
InChIKey
CLXMLXGHXQYTCQ-UHFFFAOYSA-N
Synonyms
1351681-18-9
1351681189
71753420
ethyl3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)4methylpentanoate
ethyl3(3hydroxy6(hydroxymethyl)4oxopyran2yl)4methylpentanoate
InChI=1SC14H20O6c141912(17)610(8(2)3)1413(18)11(16)59(715)2014h58101518H467H213H3
MFCD20529270
ZINC000072324625
ZINC000072324628

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Available files

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