Vitas-M small molecule compound

N-{[(2-oxo-2H-chromen-7-yl)oxy]acetyl}valine

Catalog ID
STL525145
SMILES O=C(NC(C(=O)O)C(C)C)COc1ccc2c(c1)oc(=O)cc2

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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/c1-9(2)15(16(20)21)17-13(18)8-22-11-5-3-10-4-6-14(19)23-12(10)7-11/h3-7,9,15H,8H2,1-2H3,(H,17,18)(H,20,21)
InChIKey
XWIKLCBUBMKYRT-UHFFFAOYSA-N
Synonyms
1008068-79-8
1008068798
3730729
3METHYL2((2(2OXOCHROMEN7YL)OXYACETYL)AMINO)BUTANOICACID
3METHYL2(2((2OXO2HCHROMEN7YL)OXY)ACETAMIDO)BUTANOICACID
InChI=1SC16H17NO6c19(2)15(16(20)21)1713(18)8221153104614(19)2312(10)711h37915H8H212H3(H1718)(H2021)
MFCD01547214
N(((2oxo2Hchromen7yl)oxy)acetyl)valine
ZINC000000518939
ZINC000000518940

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Available files

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