Vitas-M small molecule compound
N-{(Z)-[4-hydroxy-1-(3-methoxyphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}tyrosine
Catalog ID
STK601678
SMILES COc1cccc(c1)N1C(=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 C21H19N3O7 MW 425.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O7/c1-31-15-4-2-3-13(10-15)24-19(27)16(18(26)23-21(24)30)11-22-17(20(28)29)9-12-5-7-14(25)8-6-12/h2-8,10-11,17,22,25H,9H2,1H3,(H,28,29)(H,23,26,30)/b16-11-InChIKey
RIRYJEUYCFJRRE-WJDWOHSUSA-NSynonyms
3(4hydroxyphenyl)2(((Z)(1(3methoxyphenyl)246trioxo13diazinan5ylidene)methyl)amino)propanoicacid
COC1=CC=CC(=C1)N2C(=O)C(=CNC(CC3=CC=C(C=C3)O)C(=O)O)C(=O)NC2=O
COc1cccc(c1)N1C(=O)N=C(C(=CNC(C(=O)O)Cc2ccc(cc2)O)C1=O)O
InChI=1SC21H19N3O7c1311542313(1015)2419(27)16(18(26)2321(24)30)112217(20(28)29)9125714(25)8612h281011172225H9H21H3(H2829)(H232630)b1611
MFCD07795647
N((Z)(4hydroxy1(3methoxyphenyl)26dioxo16dihydropyrimidin5(2H)ylidene)methyl)tyrosine
ZINC000020572197
ZINC000020572199
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