Vitas-M small molecule compound
3-butan-2-yl 6-methyl 2,7-dimethyl-5-oxo-4-[2-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK405032
SMILES CCC(OC(=O)C1=C(C)NC2=C(C1c1ccccc1OC(C)C)C(=O)C(C(C2)C)C(=O)OC)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 C27H35NO6 MW 469.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO6/c1-8-16(5)34-27(31)22-17(6)28-19-13-15(4)21(26(30)32-7)25(29)24(19)23(22)18-11-9-10-12-20(18)33-14(2)3/h9-12,14-16,21,23,28H,8,13H2,1-7H3InChIKey
OKMKYMQOSYTWSJ-UHFFFAOYSA-NSynonyms
3butan2yl6methyl27dimethyl5oxo4(2(propan2yloxy)phenyl)145678hexahydroquinoline36dicarboxylate
3Obutan2yl6Omethyl27dimethyl5oxo4(2propan2yloxyphenyl)4678tetrahydro1Hquinoline36dicarboxylate
CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OC(C)C)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC27H35NO6c1816(5)3427(31)2217(6)28191315(4)21(26(30)327)25(29)24(19)23(22)18119101220(18)3314(2)3h9121416212328H813H217H3
MFCD06194101
ZINC000035898384
ZINC000229938150
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