Vitas-M small molecule compound
(2-{(Z)-[1-(2,5-dimethoxyphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STK600395
SMILES COc1ccc(cc1N1C(=O)N=C(/C(=C/c2ccccc2OCC(=O)O)/C1=O)O)OC
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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 C21H18N2O8 MW 426.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O8/c1-29-13-7-8-17(30-2)15(10-13)23-20(27)14(19(26)22-21(23)28)9-12-5-3-4-6-16(12)31-11-18(24)25/h3-10H,11H2,1-2H3,(H,24,25)(H,22,26,28)/b14-9-InChIKey
SFQGKNGENDEELU-ZROIWOOFSA-NSynonyms
373619-71-7(2((Z)(1(25dimethoxyphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
2(2((Z)(1(25DIMETHOXYPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
373619717
COC1=CC(=C(C=C1)OC)N2C(=O)C(=CC3=CC=CC=C3OCC(=O)O)C(=O)NC2=O
COc1ccc(cc1N1C(=O)N=C(C(=Cc2ccccc2OCC(=O)O)C1=O)O)OC
InChI=1SC21H18N2O8c129137817(302)15(1013)2320(27)14(19(26)2221(23)28)912534616(12)311118(24)25h310H11H212H3(H2425)(H222628)b149
MFCD08736221
ZINC000008743544
ZINC8743544
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