Vitas-M small molecule compound
2-methoxyethyl 2-methyl-5-oxo-4-(4-oxo-4H-chromen-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402760
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cccc3)C(=O)CC(C2)c1cccs1
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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 C27H25NO6S MW 491.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO6S/c1-15-23(27(31)33-10-9-32-2)24(18-14-34-21-7-4-3-6-17(21)26(18)30)25-19(28-15)12-16(13-20(25)29)22-8-5-11-35-22/h3-8,11,14,16,24,28H,9-10,12-13H2,1-2H3InChIKey
JDAIQDXRMSUUME-UHFFFAOYSA-NSynonyms
2methoxyethyl2methyl5oxo4(4oxo4Hchromen3yl)7(thiophen2yl)145678hexahydroquinoline3carboxylate
2methoxyethyl2methyl5oxo4(4oxochromen3yl)7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=COC5=CC=CC=C5C4=O)C(=O)OCCOC
InChI=1SC27H25NO6Sc11523(27(31)33109322)24(18143421743617(21)26(18)30)2519(2815)1216(1320(25)29)2285113522h381114162428H9101213H212H3
MFCD02868463
ZINC000002727205
ZINC000002727208
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