Vitas-M small molecule compound
3-(2-ethoxyethyl) 6-methyl 4-(2-butoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK405044
SMILES CCCCOc1ccccc1C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)C(=O)OCCOCC
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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 C28H37NO7 MW 499.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37NO7/c1-6-8-13-35-21-12-10-9-11-19(21)24-23(28(32)36-15-14-34-7-2)18(4)29-20-16-17(3)22(27(31)33-5)26(30)25(20)24/h9-12,17,22,24,29H,6-8,13-16H2,1-5H3InChIKey
PXZHVBDNQFBZRQ-UHFFFAOYSA-NSynonyms
3(2ethoxyethyl)6methyl4(2butoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2ethoxyethyl)6Omethyl4(2butoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCCOC1=CC=CC=C1C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OCCOCC)C
InChI=1SC28H37NO7c168133521121091119(21)2423(28(32)3615143472)18(4)29201617(3)22(27(31)335)26(30)25(20)24h91217222429H681316H215H3
MFCD06194110
ZINC000004789237
ZINC000102010160
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