DISODIUM OLEAMIDO PEG-2 SULFOSUCCINATE

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Keyword(s): Human Metabolites
Molecule Category Salt-form
UNII 9649G8O09D
EPA CompTox DTXSID701015461

Structure

InChI Key GXDRQPUNLFMMKM-MDZDMXLPSA-N
Smiles [Na+].[Na+].CCCCCCCC/C=C/CCCCCCCC(=O)NCCOCCOC(=O)CC(C([O-])=O)[S]([O-])(=O)=O
InChI
InChI=1S/C26H47NO9S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(28)27-18-19-35-20-21-36-25(29)22-23(26(30)31)37(32,33)34/h9-10,23H,2-8,11-22H2,1H3,(H,27,28)(H,30,31)(H,32,33,34)/b10-9+

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H47N1O9S1
Molecular Weight 549.3
AlogP 5.27
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 25.0
Polar Surface Area 159.79
Heavy Atoms 37.0

Cross References

Resources Reference
CAS NUMBER 56388-43-3
NORMAN SUSDAT
FDA SRS 9649G8O09D
CONTENTS