Vitas-M small molecule compound
6-methyl 3-propan-2-yl 4-(1,3-benzodioxol-5-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404525
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc3c(c1)OCO3)C(=C(N2)C)C(=O)OC(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 C24H27NO7 MW 441.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO7/c1-11(2)32-24(28)19-13(4)25-15-8-12(3)18(23(27)29-5)22(26)21(15)20(19)14-6-7-16-17(9-14)31-10-30-16/h6-7,9,11-12,18,20,25H,8,10H2,1-5H3InChIKey
KZWIGPYSXCKUMT-UHFFFAOYSA-NSynonyms
6methyl3propan2yl4(13benzodioxol5yl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3Opropan2yl4(13benzodioxol5yl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OC(C)C)C3=CC4=C(C=C3)OCO4)C(=O)C1C(=O)OC
InChI=1SC24H27NO7c111(2)3224(28)1913(4)2515812(3)18(23(27)295)22(26)21(15)20(19)14671617(914)31103016h6791112182025H810H215H3
MFCD04226265
ZINC000000816214
ZINC000239135294
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