Vitas-M small molecule compound

3-hydroxy-2-{[(5-hydroxypyridinium-3-yl)carbonyl]amino}propanoate

Catalog ID
STL529166
SMILES OCC(C(=O)[O-])NC(=O)c1c[nH+]cc(c1)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 C9H10N2O5 MW 226.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H10N2O5/c12-4-7(9(15)16)11-8(14)5-1-6(13)3-10-2-5/h1-3,7,12-13H,4H2,(H,11,14)(H,15,16)
InChIKey
NKUUBZSAYZZZBH-UHFFFAOYSA-N
Synonyms

3hydroxy2(((5hydroxypyridinium3yl)carbonyl)amino)propanoate
3HYDROXY2((5HYDROXYPYRIDIN1IUM3CARBONYL)AMINO)PROPANOATE
4979064
InChI=1SC9H10N2O5c1247(9(15)16)118(14)516(13)31025h1371213H4H2(H1114)(H1516)
MFCD02221583
ZINC000000182880
ZINC000000182882

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Available files

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