Vitas-M small molecule compound
(1R)-6-hydroxy-3-[(3-hydroxy-2-phenylpropanoyl)oxy]-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane
Catalog ID
STK029449
SMILES OCC(c1ccccc1)C(=O)OC1CC2CC(C(C1)[N+]2(C)C)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 C18H26NO4 MW 320.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26NO4/c1-19(2)13-8-14(10-16(19)17(21)9-13)23-18(22)15(11-20)12-6-4-3-5-7-12/h3-7,13-17,20-21H,8-11H2,1-2H3/q+1InChIKey
IYSMYVOALXTCSU-UHFFFAOYSA-NSynonyms
(1R)6HYDROXY3((3HYDROXY2PHENYLPROPANOYL)OXY)88DIMETHYL8AZONIABICYCLO(321)OCTANE
(6HYDROXY88DIMETHYL8AZONIABICYCLO(321)OCTAN3YL)3HYDROXY2PHENYLPROPANOATE
C(N+)1(C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3)C
InChI=1SC18H26NO4c119(2)13814(1016(19)17(21)913)2318(22)15(1120)126435712h3713172021H811H212H3q+1
MFCD01548175
OCC(c1ccccc1)C(=O)OC1CC2CC(C(C1)(N+)2(C)C)O
STK029449
ZINC000104010016
ZINC000226761523
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