Vitas-M small molecule compound
methyl 2,7,7-trimethyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK094924
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1OC)OC)C(=O)CC(C2)(C)C
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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 C23H29NO6 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO6/c1-12-19(22(26)30-7)20(21-14(24-12)10-23(2,3)11-15(21)25)13-8-17(28-5)18(29-6)9-16(13)27-4/h8-9,20,24H,10-11H2,1-7H3InChIKey
NUQYWRBXGKKMFI-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3OC)OC)OC)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1OC)OC)C(=O)CC(C2)(C)C
InChI=1SC23H29NO6c11219(22(26)307)20(2114(2412)1023(23)1115(21)25)13817(285)18(296)916(13)274h892024H1011H217H3
methyl277trimethyl5oxo4(245trimethoxyphenyl)145678hexahydroquinoline3carboxylate
methyl277trimethyl5oxo4(245trimethoxyphenyl)1468tetrahydroquinoline3carboxylate
MFCD01237669
STK094924
ZINC000000628668
ZINC000000628675
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