Vitas-M small molecule compound
3-butan-2-yl 6-methyl 4-(3-ethoxy-4-hydroxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK405031
SMILES CCOc1cc(ccc1O)C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)C(=O)OC(CC)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 C26H33NO7 MW 471.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO7/c1-7-14(4)34-26(31)21-15(5)27-17-11-13(3)20(25(30)32-6)24(29)23(17)22(21)16-9-10-18(28)19(12-16)33-8-2/h9-10,12-14,20,22,27-28H,7-8,11H2,1-6H3InChIKey
SJPWJSOQEIUQRL-UHFFFAOYSA-NSynonyms
3butan2yl6methyl4(3ethoxy4hydroxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Obutan2yl6Omethyl4(3ethoxy4hydroxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)O)OCC)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC26H33NO7c1714(4)3426(31)2115(5)27171113(3)20(25(30)326)24(29)23(17)22(21)1691018(28)19(1216)3382h910121420222728H7811H216H3
MFCD06194100
ZINC000001461138
ZINC000139067301
Check stock
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Check stock on Vitas-MAvailable files
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