Vitas-M small molecule compound
ethyl 3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-(pyridin-4-yl)propanoate
Catalog ID
STL433930
SMILES CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccncc1
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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 C16H17NO6 MW 319.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO6/c1-2-22-14(20)8-12(10-3-5-17-6-4-10)16-15(21)13(19)7-11(9-18)23-16/h3-7,12,18,21H,2,8-9H2,1H3InChIKey
JNMBENFTGXXDBS-UHFFFAOYSA-NSynonyms
CCOC(=O)CC(C1=CC=NC=C1)C2=C(C(=O)C=C(O2)CO)O
ethyl3(3hydroxy6(hydroxymethyl)4oxo4Hpyran2yl)3(pyridin4yl)propanoate
ethyl3(3hydroxy6(hydroxymethyl)4oxopyran2yl)3pyridin4ylpropanoate
InChI=1SC16H17NO6c122214(20)812(1035176410)1615(21)13(19)711(918)2316h37121821H289H21H3
MFCD26098187
ZINC000078549323
ZINC000078549327
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