Vitas-M small molecule compound
(5Z)-3-(butan-2-yl)-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STK585208
SMILES CCC(N1C(=O)N=C(/C(=C/Nc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=NC(=NC2=O)O)O)/C1=O)O)C
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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 C25H29N7O6 MW 523.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N7O6/c1-4-13(2)32-20(34)16(19(33)27-24(32)38)11-26-15-5-6-17-14(9-15)10-25(18-12-30(3)7-8-31(17)18)21(35)28-23(37)29-22(25)36/h5-6,9,11,13,18,26H,4,7-8,10,12H2,1-3H3,(H,27,33,38)(H2,28,29,35,36,37)/b16-11-InChIKey
UGKIYTBSBYWKHD-WJDWOHSUSA-NSynonyms
(5Z)3(butan2yl)5(((26dihydroxy3methyl4oxo2344atetrahydro1H4H6Hspiro(pyrazino(12a)quinoline55pyrimidin)8yl)amino)methylidene)6hydroxypyrimidine24(3H5H)dione
CCC(N1C(=O)N=C(C(=CNc2ccc3c(c2)CC2(C4N3CCN(C4)C)C(=NC(=NC2=O)O)O)C1=O)O)C
MFCD07211094
ZINC000018087839
ZINC000035435268
Check stock
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Check stock on Vitas-MAvailable files
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