14485-20-2 Purity
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Specification
The PubChem CID for Tritoqualine is 72145.
The molecular formula of Tritoqualine is C26H32N2O8.
The molecular weight of Tritoqualine is 500.5 g/mol.
Tritoqualine was created on August 8, 2005.
The IUPAC name of Tritoqualine is 7-amino-4,5,6-triethoxy-3-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-3H-2-benzofuran-1-one.
The InChIKey of Tritoqualine is IRGJVQIJENCTQF-UHFFFAOYSA-N.
The canonical SMILES of Tritoqualine is CCOC1=C(C(=C(C2=C1C(OC2=O)C3C4=C(C5=C(C=C4CCN3C)OCO5)OC)N)OCC)OCC.
The CAS number of Tritoqualine is 14504-73-5.
The XLogP3-AA value of Tritoqualine is 3.7.
The hydrogen bond acceptor count of Tritoqualine is 10.