Vitas-M small molecule compound
ethyl 2,7,7-trimethyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363797
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cc(cc3)C)C(=O)CC(C2)(C)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 C25H27NO5 MW 421.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO5/c1-6-30-24(29)20-14(3)26-17-10-25(4,5)11-18(27)22(17)21(20)16-12-31-19-8-7-13(2)9-15(19)23(16)28/h7-9,12,21,26H,6,10-11H2,1-5H3InChIKey
LEFVGJXKXLHEQE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC2=C(C1C3=COC4=C(C3=O)C=C(C=C4)C)C(=O)CC(C2)(C)C)C
ethyl277trimethyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
ethyl277trimethyl4(6methyl4oxochromen3yl)5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC25H27NO5c163024(29)2014(3)26171025(45)1118(27)22(17)21(20)161231198713(2)915(19)23(16)28h79122126H61011H215H3
MFCD01824480
ZINC000019782011
ZINC000019782012
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Check stock on Vitas-MAvailable files
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