Vitas-M small molecule compound

bis(2-methylpropyl) 2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate

Catalog ID
STK772170
SMILES CC(COC(=O)C1C(=O)CC(C(C1c1ccc(cc1)N(C)C)C(=O)OCC(C)C)(C)O)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 C25H37NO6 MW 447.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H37NO6/c1-15(2)13-31-23(28)21-19(27)12-25(5,30)22(24(29)32-14-16(3)4)20(21)17-8-10-18(11-9-17)26(6)7/h8-11,15-16,20-22,30H,12-14H2,1-7H3
InChIKey
KAHRRBTTZSYVLT-UHFFFAOYSA-N
Synonyms
1005280-38-5
1005280385
bis(2methylpropyl)2(4(dimethylamino)phenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
BIS(2METHYLPROPYL)2(4DIMETHYLAMINOPHENYL)4HYDROXY4METHYL6OXOCYCLOHEXANE13DICARBOXYLATE
CC(C)COC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC(C)C)C2=CC=C(C=C2)N(C)C
DIISOBUTYL2(4(DIMETHYLAMINO)PHENYL)4HYDROXY4METHYL6OXO13CYCLOHEXANEDICARBOXYLATE
diisobutyl2(4(dimethylamino)phenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
InChI=1SC25H37NO6c115(2)133123(28)2119(27)1225(530)22(24(29)321416(3)4)20(21)1781018(11917)26(6)7h8111516202230H1214H217H3
MFCD03289961
ZINC000008438612
ZINC000013563934

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Available files

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