Vitas-M small molecule compound
3-cyclopentyl 6-methyl 4-(3-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404664
SMILES CCOc1cccc(c1)C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)C(=O)OC1CCCC1
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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 C27H33NO6 MW 467.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO6/c1-5-33-19-12-8-9-17(14-19)23-22(27(31)34-18-10-6-7-11-18)16(3)28-20-13-15(2)21(26(30)32-4)25(29)24(20)23/h8-9,12,14-15,18,21,23,28H,5-7,10-11,13H2,1-4H3InChIKey
OJCJFXYMQCHQGH-UHFFFAOYSA-NSynonyms
3cyclopentyl6methyl4(3ethoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Ocyclopentyl6Omethyl4(3ethoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCOC1=CC=CC(=C1)C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OC4CCCC4)C
InChI=1SC27H33NO6c153319128917(1419)2322(27(31)341810671118)16(3)28201315(2)21(26(30)324)25(29)24(20)23h8912141518212328H57101113H214H3
MFCD06193915
ZINC000001460859
ZINC000102009442
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