Vitas-M small molecule compound

methyl 5-[3-amino-1-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-oxopropyl]-4,6-dihydroxypyridine-3-carboxylate

Catalog ID
STL493750
SMILES COC(=O)c1cnc(c(c1O)C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)CC(=O)N)O

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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 C24H32N2O6 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N2O6/c1-23(2,3)15-8-12(9-16(20(15)29)24(4,5)6)13(10-17(25)27)18-19(28)14(22(31)32-7)11-26-21(18)30/h8-9,11,13,29H,10H2,1-7H3,(H2,25,27)(H2,26,28,30)
InChIKey
JMTFYPAHXKIFAX-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(CC(=O)N)C2=C(C(=CNC2=O)C(=O)OC)O
InChI=1SC24H32N2O6c123(23)15812(916(20(15)29)24(45)6)13(1017(25)27)1819(28)14(22(31)327)112621(18)30h89111329H10H217H3(H22527)(H2262830)
methyl5(3amino1(35ditertbutyl4hydroxyphenyl)3oxopropyl)46dihydroxypyridine3carboxylate
methyl5(3amino1(35ditertbutyl4hydroxyphenyl)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
MFCD30715973
ZINC000253623748
ZINC000253623749

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Available files

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