Vitas-M small molecule compound

7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-5'-{3-[(2-methylprop-2-en-1-yl)oxy]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
STL551555
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1cccc(c1)OCC(=C)C)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 C33H32ClN3O8 MW 634.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32ClN3O8/c1-15(2)14-44-18-10-8-9-17(12-18)22-23-19(35-30-25(22)31(40)37(5)32(41)36(30)4)11-16(3)33(28(23)38)29(39)24-20(42-6)13-21(43-7)26(34)27(24)45-33/h8-10,12-13,16,22,38H,1,11,14H2,2-7H3
InChIKey
KCIZJAXRXYCDDJ-UHFFFAOYSA-N
Synonyms
7chloro6hydroxy46dimethoxy138trimethyl5(3((2methylprop2en1yl)oxy)phenyl)1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
Registry IDs
MFCD31758203
ZINC000888090590
ZINC000888090593

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Available files

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