Vitas-M small molecule compound
(5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-ylidene]-3-methylpyrimidine-2,4(3H,5H)-dione
Catalog ID
STK607307
SMILES COc1cc(/C=C/C(=C/2\C(=NC(=O)N(C2=O)C)O)/O)cc(c1OC)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 C17H18N2O7 MW 362.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O7/c1-19-16(22)13(15(21)18-17(19)23)10(20)6-5-9-7-11(24-2)14(26-4)12(8-9)25-3/h5-8,20H,1-4H3,(H,18,21,23)/b6-5+,13-10-InChIKey
HUWQHPIHVRETFR-KWQUGSDZSA-NSynonyms
(5Z)5((E)1hydroxy3(345trimethoxyphenyl)prop2enylidene)1methyl13diazinane246trione
(5Z)6hydroxy5((2E)1hydroxy3(345trimethoxyphenyl)prop2en1ylidene)3methylpyrimidine24(3H5H)dione
CN1C(=O)C(=C(C=CC2=CC(=C(C(=C2)OC)OC)OC)O)C(=O)NC1=O
COc1cc(C=CC(=C2C(=NC(=O)N(C2=O)C)O)O)cc(c1OC)OC
InChI=1SC17H18N2O7c11916(22)13(15(21)1817(19)23)10(20)659711(242)14(264)12(89)253h5820H14H3(H182123)b65+1310
MFCD07797665
ZINC000101390045
ZINC101390045
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