Vitas-M small molecule compound
2-methoxyethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403086
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cc(cc3)C)C(=O)CC(C2)c1ccccc1Cl
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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 C30H28ClNO6 MW 534.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClNO6/c1-16-8-9-25-20(12-16)29(34)21(15-38-25)27-26(30(35)37-11-10-36-3)17(2)32-23-13-18(14-24(33)28(23)27)19-6-4-5-7-22(19)31/h4-9,12,15,18,27,32H,10-11,13-14H2,1-3H3InChIKey
XOCLGPRHSZFPMO-UHFFFAOYSA-NSynonyms
2methoxyethyl7(2chlorophenyl)2methyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl7(2chlorophenyl)2methyl4(6methyl4oxochromen3yl)5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)C5=CC=CC=C5Cl)NC(=C3C(=O)OCCOC)C
InChI=1SC30H28ClNO6c116892520(1216)29(34)21(153825)2726(30(35)371110363)17(2)32231318(1424(33)28(23)27)19645722(19)31h491215182732H10111314H213H3
MFCD03371076
ZINC000097939623
ZINC000097939626
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