Vitas-M small molecule compound
methyl 4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STL175872
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(COc3c(OC)cccc3OC)c(cc1C)C)C(=O)CCC2
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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 C29H33NO6 MW 491.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO6/c1-16-13-17(2)20(14-19(16)15-36-28-23(33-4)11-8-12-24(28)34-5)26-25(29(32)35-6)18(3)30-21-9-7-10-22(31)27(21)26/h8,11-14,26,30H,7,9-10,15H2,1-6H3InChIKey
GVMGHAOMHUSZKP-UHFFFAOYSA-NSynonyms
438229-46-0438229460
CC1=CC(=C(C=C1C2C3=C(CCCC3=O)NC(=C2C(=O)OC)C)COC4=C(C=CC=C4OC)OC)C
InChI=1SC29H33NO6c1161317(2)20(1419(16)15362823(334)1181224(28)345)2625(29(32)356)18(3)3021971022(31)27(21)26h811142630H791015H216H3
methyl4(5((26dimethoxyphenoxy)methyl)24dimethylphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(5((26dimethoxyphenoxy)methyl)24dimethylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD03075242
ZINC000008441843
ZINC000008441844
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