Vitas-M small molecule compound

1-(2-hydroxy-11-methoxy-11-oxoundecyl)-1-methylpiperidinium

Catalog ID
STL059142
SMILES COC(=O)CCCCCCCCC(C[N+]1(C)CCCCC1)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 C18H36NO3 MW 314.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H36NO3/c1-19(14-10-7-11-15-19)16-17(20)12-8-5-3-4-6-9-13-18(21)22-2/h17,20H,3-16H2,1-2H3/q+1
InChIKey
FMKJRBPZIVEGSX-UHFFFAOYSA-N
Synonyms

1(2hydroxy11methoxy11oxoundecyl)1methylpiperidin1iumiodide
1(2hydroxy11methoxy11oxoundecyl)1methylpiperidinium
C(N+)1(CCCCC1)CC(CCCCCCCCC(=O)OC)O
COC(=O)CCCCCCCCC(C(N+)1(C)CCCCC1)O
COC(=O)CCCCCCCCC(C(N+)1(C)CCCCC1)O(I)
InChI=1SC18H36NO3c119(14107111519)1617(20)128534691318(21)222h1720H316H212H3q+1
METHYL10HYDROXY11(1METHYLPIPERIDIN1IUM1YL)UNDECANOATE
ZINC000004828741
ZINC000004828742

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.