Vitas-M small molecule compound
(5Z)-6-hydroxy-5-[(2E)-1-hydroxy-3-(4-methoxyphenyl)prop-2-en-1-ylidene]-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK594980
SMILES COCCCN1C(=O)N=C(/C(=C(\C=C\c2ccc(cc2)OC)/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 C18H20N2O6 MW 360.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O6/c1-25-11-3-10-20-17(23)15(16(22)19-18(20)24)14(21)9-6-12-4-7-13(26-2)8-5-12/h4-9,21H,3,10-11H2,1-2H3,(H,19,22,24)/b9-6+,15-14-InChIKey
NCIMJPOSHPTNQD-XOYPXTSZSA-NSynonyms
(5Z)5((E)1hydroxy3(4methoxyphenyl)prop2enylidene)1(3methoxypropyl)13diazinane246trione
(5Z)6hydroxy5((2E)1hydroxy3(4methoxyphenyl)prop2en1ylidene)3(3methoxypropyl)pyrimidine24(3H5H)dione
COCCCN1C(=O)C(=C(C=CC2=CC=C(C=C2)OC)O)C(=O)NC1=O
COCCCN1C(=O)N=C(C(=C(C=Cc2ccc(cc2)OC)O)C1=O)O
InChI=1SC18H20N2O6c125113102017(23)15(16(22)1918(20)24)14(21)96124713(262)8512h4921H31011H212H3(H192224)b96+1514
MFCD07795983
ZINC000101378496
ZINC101378496
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