Vitas-M small molecule compound

N-[(Z)-(1-ethyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]tyrosine

Catalog ID
STK614431
SMILES CCN1C(=O)N=C(/C(=C/NC(C(=O)O)Cc2ccc(cc2)O)/C1=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 C16H17N3O6 MW 347.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O6/c1-2-19-14(22)11(13(21)18-16(19)25)8-17-12(15(23)24)7-9-3-5-10(20)6-4-9/h3-6,8,12,17,20H,2,7H2,1H3,(H,23,24)(H,18,21,25)/b11-8-
InChIKey
IPUBUESWGPPOPU-FLIBITNWSA-N
Synonyms

2(((Z)(1ethyl246trioxo13diazinan5ylidene)methyl)amino)3(4hydroxyphenyl)propanoicacid
CCN1C(=O)C(=CNC(CC2=CC=C(C=C2)O)C(=O)O)C(=O)NC1=O
CCN1C(=O)N=C(C(=CNC(C(=O)O)Cc2ccc(cc2)O)C1=O)O
InChI=1SC16H17N3O6c121914(22)11(13(21)1816(19)25)81712(15(23)24)793510(20)649h368121720H27H21H3(H2324)(H182125)b118
MFCD07797898
N((Z)(1ethyl4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)tyrosine
ZINC000020567762
ZINC000020567763

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Available files

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