Vitas-M small molecule compound

2-methoxyethyl 2-methyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK372507
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)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 C23H29NO7 MW 431.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO7/c1-13-19(23(26)31-10-9-27-2)20(21-15(24-13)7-6-8-16(21)25)14-11-17(28-3)22(30-5)18(12-14)29-4/h11-12,20,24H,6-10H2,1-5H3
InChIKey
YBDCYJWPEVIIMG-UHFFFAOYSA-N
Synonyms

2methoxyethyl2methyl5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
2methoxyethyl2methyl5oxo4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OCCOC
InChI=1SC23H29NO7c11319(23(26)31109272)20(2115(2413)76816(21)25)141117(283)22(305)18(1214)294h11122024H610H215H3
MFCD00752947
ZINC000003094373
ZINC000003094374

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Available files

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