Vitas-M small molecule compound
methyl 4-(3-methoxy-4-propoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363213
SMILES CCCOc1ccc(cc1OC)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC
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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 C22H27NO5 MW 385.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO5/c1-5-11-28-17-10-9-14(12-18(17)26-3)20-19(22(25)27-4)13(2)23-15-7-6-8-16(24)21(15)20/h9-10,12,20,23H,5-8,11H2,1-4H3InChIKey
LZMWNUDCDTUNNQ-UHFFFAOYSA-NSynonyms
299451-71-1299451711
CCCOC1=C(C=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OC)C)OC
InChI=1SC22H27NO5c1511281710914(1218(17)263)2019(22(25)274)13(2)231576816(24)21(15)20h910122023H5811H214H3
methyl4(3methoxy4propoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(3methoxy4propoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD00717835
ZINC000004062102
ZINC000004062103
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