Vitas-M small molecule compound
N-[(Z)-(4-hydroxy-2,6-dioxo-1-phenyl-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]aspartic acid
Catalog ID
STK615687
SMILES OC(=O)CC(C(=O)O)N/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1)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 C15H13N3O7 MW 347.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O7/c19-11(20)6-10(14(23)24)16-7-9-12(21)17-15(25)18(13(9)22)8-4-2-1-3-5-8/h1-5,7,10,16H,6H2,(H,19,20)(H,23,24)(H,17,21,25)/b9-7-InChIKey
DBESDXWFLZKGOX-CLFYSBASSA-NSynonyms
2(((Z)(246trioxo1phenyl13diazinan5ylidene)methyl)amino)butanedioicacid
C1=CC=C(C=C1)N2C(=O)C(=CNC(CC(=O)O)C(=O)O)C(=O)NC2=O
InChI=1SC15H13N3O7c1911(20)610(14(23)24)167912(21)1715(25)18(13(9)22)8421358h1571016H6H2(H1920)(H2324)(H172125)b97
MFCD08731549
N((Z)(4hydroxy26dioxo1phenyl16dihydropyrimidin5(2H)ylidene)methyl)asparticacid
OC(=O)CC(C(=O)O)NC=C1C(=NC(=O)N(C1=O)c1ccccc1)O
ZINC000020589132
ZINC000020589135
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