947592-41-8 Purity
96%
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Specification
The molecular formula is C24H43NO12S.
One synonym is AKOS030213440.
The molecular weight is 569.7 g/mol.
The IUPAC name is (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[2-[2-[2-(2-methylsulfanylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate.
The InChI is InChI=1S/C24H43NO12S/c1-38-21-20-36-19-18-35-17-16-34-15-14-33-13-12-32-11-10-31-9-8-30-7-6-29-5-4-24(28)37-25-22(26)2-3-23(25)27/h2-21H2,1H3.
The InChIKey is YDMWVJJJERIULX-UHFFFAOYSA-N.
The canonical SMILES is CSCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O.
The XLogP3-AA value is -1.4.
It has 0 hydrogen bond donor counts.
It has 13 hydrogen bond acceptor counts.