Vitas-M small molecule compound

3-(2-methoxyethyl) 6-methyl 4-(4-hydroxy-3,5-dimethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK404830
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(c(c1)OC)O)C(=O)C(C(C2)C)C(=O)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 C25H31NO9 MW 489.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO9/c1-12-9-15-21(23(28)18(12)24(29)34-6)20(14-10-16(32-4)22(27)17(11-14)33-5)19(13(2)26-15)25(30)35-8-7-31-3/h10-12,18,20,26-27H,7-9H2,1-6H3
InChIKey
OHGRKQICVPIWCI-UHFFFAOYSA-N
Synonyms

3(2methoxyethyl)6methyl4(4hydroxy35dimethoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2methoxyethyl)6Omethyl4(4hydroxy35dimethoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OCCOC)C3=CC(=C(C(=C3)OC)O)OC)C(=O)C1C(=O)OC
InChI=1SC25H31NO9c11291521(23(28)18(12)24(29)346)20(141016(324)22(27)17(1114)335)19(13(2)2615)25(30)3587313h101218202627H79H216H3
MFCD06194002
ZINC000004761778
ZINC000004761834

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Available files

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