Vitas-M small molecule compound
methyl 7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(3-phenoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK003208
SMILES COC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Oc1ccccc1)C(=O)CC(C2)c1ccc(c(c1)OC)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 C32H31NO6 MW 525.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31NO6/c1-19-29(32(35)38-4)30(21-9-8-12-24(15-21)39-23-10-6-5-7-11-23)31-25(33-19)16-22(17-26(31)34)20-13-14-27(36-2)28(18-20)37-3/h5-15,18,22,30,33H,16-17H2,1-4H3InChIKey
TVLKHBHGDUHJNK-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=C(C=C3)OC)OC)C4=CC(=CC=C4)OC5=CC=CC=C5)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Oc1ccccc1)C(=O)CC(C2)c1ccc(c(c1)OC)OC
InChI=1SC32H31NO6c11929(32(35)384)30(21981224(1521)3923106571123)3125(3319)1622(1726(31)34)20131427(362)28(1820)373h51518223033H1617H214H3
methyl7(34dimethoxyphenyl)2methyl5oxo4(3phenoxyphenyl)145678hexahydroquinoline3carboxylate
methyl7(34dimethoxyphenyl)2methyl5oxo4(3phenoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
MFCD02224217
STK003208
ZINC000000679037
ZINC000000679051
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