Vitas-M small molecule compound
7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-5'-{4-[(1-methyl-1H-imidazol-2-yl)methoxy]phenyl}-1',5',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4'(3'H)-trione
Catalog ID
STL551266
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(cc1)OCc1nccn1C)c(=O)n(c(=O)n3C)C)Cl
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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 C34H32ClN5O8 MW 674.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32ClN5O8/c1-16-13-19-24(29(41)34(16)30(42)25-20(45-5)14-21(46-6)27(35)28(25)48-34)23(26-31(37-19)39(3)33(44)40(4)32(26)43)17-7-9-18(10-8-17)47-15-22-36-11-12-38(22)2/h7-12,14,16,23,41H,13,15H2,1-6H3InChIKey
RIYYKOZMAGPHTE-UHFFFAOYSA-NSynonyms
7chloro6hydroxy46dimethoxy138trimethyl5(4((1methyl1Himidazol2yl)methoxy)phenyl)1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC34H32ClN5O8c116131924(29(41)34(16)30(42)2520(455)1421(466)27(35)28(25)4834)23(2631(3719)39(3)33(44)40(4)32(26)43)177918(10817)47152236111238(22)2h71214162341H1315H216H3
MFCD31758036
ZINC000888088789
ZINC000888088792
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