Vitas-M small molecule compound

N-[3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]-beta-alanine

Catalog ID
STL520913
SMILES O=C(CCc1c(=O)oc2c(c1C)ccc(c2)O)NCCC(=O)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 C16H17NO6 MW 319.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO6/c1-9-11-3-2-10(18)8-13(11)23-16(22)12(9)4-5-14(19)17-7-6-15(20)21/h2-3,8,18H,4-7H2,1H3,(H,17,19)(H,20,21)
InChIKey
LKSLCKHDOPWGLL-UHFFFAOYSA-N
Synonyms
858767-54-1
3(3(7HYDROXY4METHYL2OXO2HCHROMEN3YL)PROPANAMIDO)PROPANOICACID
3(3(7HYDROXY4METHYL2OXOCHROMEN3YL)PROPANOYLAMINO)PROPANOICACID
5915740
858767541
InChI=1SC16H17NO6c19113210(18)813(11)2316(22)12(9)4514(19)177615(20)21h23818H47H21H3(H1719)(H2021)
MFCD04145120
N(3(7hydroxy4methyl2oxo2Hchromen3yl)propanoyl)betaalanine
ZINC000002103417
ZINC2103417

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Available files

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