Vitas-M small molecule compound
(5Z)-3-(4-fluorophenyl)-6-hydroxy-5-[(2E)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK614786
SMILES COc1cc(/C=C/C(=C/2\C(=NC(=O)N(C2=O)c2ccc(cc2)F)O)/O)ccc1O
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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 C20H15FN2O6 MW 398.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN2O6/c1-29-16-10-11(2-8-14(16)24)3-9-15(25)17-18(26)22-20(28)23(19(17)27)13-6-4-12(21)5-7-13/h2-10,24-25H,1H3,(H,22,26,28)/b9-3+,17-15-InChIKey
PFQCYYRUIDVHIU-PDDQHUICSA-NSynonyms
(5Z)1(4fluorophenyl)5((E)1hydroxy3(4hydroxy3methoxyphenyl)prop2enylidene)13diazinane246trione
(5Z)3(4fluorophenyl)6hydroxy5((2E)1hydroxy3(4hydroxy3methoxyphenyl)prop2en1ylidene)pyrimidine24(3H5H)dione
COC1=C(C=CC(=C1)C=CC(=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F)O)O
COc1cc(C=CC(=C2C(=NC(=O)N(C2=O)c2ccc(cc2)F)O)O)ccc1O
InChI=1SC20H15FN2O6c129161011(2814(16)24)3915(25)1718(26)2220(28)23(19(17)27)136412(21)5713h2102425H1H3(H222628)b93+1715
MFCD07797708
ZINC000101385196
ZINC101385196
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