Vitas-M small molecule compound
N,N-diethyl-2-oxo-N-(2-oxo-2-{[(4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]oxy}ethyl)-2-{[(4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl]oxy}ethanaminium
Catalog ID
STL552692
SMILES CC[N+](CC(=O)OC1CC2C(C1(C)CC2)(C)C)(CC(=O)OC1CC2C(C1(C)CC2)(C)C)CC
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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 C28H48NO4 MW 462.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H48NO4/c1-9-29(10-2,17-23(30)32-21-15-19-11-13-27(21,7)25(19,3)4)18-24(31)33-22-16-20-12-14-28(22,8)26(20,5)6/h19-22H,9-18H2,1-8H3/q+1InChIKey
MFUCFIXJPGPRBR-UHFFFAOYSA-NSynonyms
3593362
CC(N+)(CC(=O)OC1CC2C(C1(C)CC2)(C)C)(CC(=O)OC1CC2C(C1(C)CC2)(C)C)CC(Cl)
diethylbis(2oxo2((177trimethyl2bicyclo(221)heptanyl)oxy)ethyl)azanium
DIETHYLBIS(2OXO2((477TRIMETHYL3BICYCLO(221)HEPTANYL)OXY)ETHYL)AZANIUM
InChI=1SC28H48NO4c1929(1021723(30)32211519111327(217)25(193)4)1824(31)33221620121428(228)26(205)6h1922H918H218H3q+1
NNdiethyl2oxoN(2oxo2(((1S2S4S)177trimethylbicyclo(221)heptan2yl)oxy)ethyl)2(((1S4S)177trimethylbicyclo(221)heptan2yl)oxy)ethanaminiumchloride
NNdiethyl2oxoN(2oxo2(((4R)177trimethylbicyclo(221)hept2yl)oxy)ethyl)2(((4R)177trimethylbicyclo(221)hept2yl)oxy)ethanaminium
ZINC000100744193
ZINC000252441254
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