Vitas-M small molecule compound
cyclohexyl 2,7,7-trimethyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407301
SMILES COc1cc(OC)c(cc1C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1)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 C28H37NO6 MW 483.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37NO6/c1-16-24(27(31)35-17-10-8-7-9-11-17)25(26-19(29-16)14-28(2,3)15-20(26)30)18-12-22(33-5)23(34-6)13-21(18)32-4/h12-13,17,25,29H,7-11,14-15H2,1-6H3InChIKey
OZIBGJYWKYTZFN-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3OC)OC)OC)C(=O)OC4CCCCC4
cyclohexyl277trimethyl5oxo4(245trimethoxyphenyl)145678hexahydroquinoline3carboxylate
cyclohexyl277trimethyl5oxo4(245trimethoxyphenyl)1468tetrahydroquinoline3carboxylate
InChI=1SC28H37NO6c11624(27(31)3517108791117)25(2619(2916)1428(23)1520(26)30)181222(335)23(346)1321(18)324h1213172529H7111415H216H3
MFCD02633242
ZINC000020568770
ZINC000020568771
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