Vitas-M small molecule compound

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

Catalog ID
STL537831
SMILES OCC(C(C(C(C1N2CC3(CN1CC(C2)(C3=O)C(C)C)C(C)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 C19H34N2O6 MW 386.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H34N2O6/c1-10(2)18-6-20-8-19(11(3)4,17(18)27)9-21(7-18)16(20)15(26)14(25)13(24)12(23)5-22/h10-16,22-26H,5-9H2,1-4H3
InChIKey
WOPHSSJTAPPKNL-UHFFFAOYSA-N
Synonyms
1009595-63-4
(1R5R)57diisopropyl2(12345pentahydroxypentyl)13diazaadamantan6one
1009595634
1C(6oxo57di(propan2yl)13diazatricyclo(3311~37~)dec2yl)pentitol
2(12345pentahydroxypentyl)57di(propan2yl)13diazatricyclo(3311^(37))decan6one
3719101
InChI=1SC19H34N2O6c110(2)18620819(11(3)417(18)27)921(718)16(20)15(26)14(25)13(24)12(23)522h10162226H59H214H3
MFCD03808917
OCC(C(C(C(C1N2CC3(CN1C(C@@)(C2)(C3=O)C(C)C)C(C)C)O)O)O)O
ZINC000019323200
ZINC000239432827

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Available files

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