Vitas-M small molecule compound

N-[(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]-beta-alanine

Catalog ID
STL464325
SMILES COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=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 C17H19NO6 MW 333.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO6/c1-9-6-12(23-3)16-10(2)11(17(22)24-13(16)7-9)8-14(19)18-5-4-15(20)21/h6-7H,4-5,8H2,1-3H3,(H,18,19)(H,20,21)
InChIKey
DJPSGQRGPKNACT-UHFFFAOYSA-N
Synonyms
859130-80-6
3((2(5METHOXY47DIMETHYL2OXOCHROMEN3YL)ACETYL)AMINO)PROPANOICACID
3(2(5methoxy47dimethyl2oxo2Hchromen3yl)acetamido)propanoicacid
859130806
CC1=CC2=C(C(=C(C(=O)O2)CC(=O)NCCC(=O)O)C)C(=C1)OC
InChI=1SC17H19NO6c19612(233)1610(2)11(17(22)2413(16)79)814(19)185415(20)21h67H458H213H3(H1819)(H2021)
MFCD05677092
N((5methoxy47dimethyl2oxo2Hchromen3yl)acetyl)betaalanine
ZINC000002125703
ZINC2125703

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Available files

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