Vitas-M small molecule compound

1-C-(5-ethyl-7-methyl-6-oxo-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)pentitol

Catalog ID
STK688878
SMILES OCC(C(C(C(C1N2CC3(CN1CC(C2)(C3=O)CC)C)O)O)O)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 C16H28N2O6 MW 344.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H28N2O6/c1-3-16-7-17-5-15(2,14(16)24)6-18(8-16)13(17)12(23)11(22)10(21)9(20)4-19/h9-13,19-23H,3-8H2,1-2H3
InChIKey
CHLXQBZFVSOSDK-UHFFFAOYSA-N
Synonyms
1C(5ethyl7methyl6oxo13diazatricyclo(3311~37~)dec2yl)pentitol
CCC12CN3CC(C1=O)(CN(C2)C3C(C(C(C(CO)O)O)O)O)C
Registry IDs
MFCD07658911
ZINC000019325676
ZINC000245254825

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Available files

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