Vitas-M small molecule compound

propyl 4-(2,3-dimethoxyphenyl)-7-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK402952
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)c1ccccc1OC

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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/c1-6-14-36-29(32)25-17(2)30-21-15-18(19-10-7-8-12-23(19)33-3)16-22(31)27(21)26(25)20-11-9-13-24(34-4)28(20)35-5/h7-13,18,26,30H,6,14-16H2,1-5H3
InChIKey
CQWYXVNTEIMBSB-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(NC2=C(C1C3=C(C(=CC=C3)OC)OC)C(=O)CC(C2)C4=CC=CC=C4OC)C
InChI=1SC29H33NO6c16143629(32)2517(2)30211518(1910781223(19)333)1622(31)27(21)26(25)201191324(344)28(20)355h713182630H61416H215H3
MFCD03370979
propyl4(23dimethoxyphenyl)7(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl4(23dimethoxyphenyl)7(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
ZINC000002772114
ZINC000002772117

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.