Vitas-M small molecule compound
propyl 2,7,7-trimethyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK068886
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1OC)OC)OC)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 C25H33NO6 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33NO6/c1-8-11-32-24(28)19-14(2)26-16-12-25(3,4)13-17(27)21(16)20(19)15-9-10-18(29-5)23(31-7)22(15)30-6/h9-10,20,26H,8,11-13H2,1-7H3InChIKey
YGWXTNLCOQROKU-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1OC)OC)OC)C(=O)CC(C2)(C)C
CCCOC(=O)C1=C(NC2=C(C1C3=C(C(=C(C=C3)OC)OC)OC)C(=O)CC(C2)(C)C)C
InChI=1SC25H33NO6c18113224(28)1914(2)26161225(34)1317(27)21(16)20(19)1591018(295)23(317)22(15)306h9102026H81113H217H3
MFCD00753142
propyl277trimethyl5oxo4(234trimethoxyphenyl)145678hexahydroquinoline3carboxylate
propyl277trimethyl5oxo4(234trimethoxyphenyl)1468tetrahydroquinoline3carboxylate
STK068886
ZINC000002055255
ZINC000002055256
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