Registration Dossier

Reference substances

Reference substances

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General information

Inventory

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Reference substance information

IUPAC name:
Butanedioic acid, 3-sulfo-, 1-[2-[(1-oxo-octadecyl)amino]ethyl] ester, sodium salt

Molecular and structural information

Molecular formula:
C24H43NNa2O8S
Molecular weight:
ca. 551
SMILES notation:
O=C(OCCNC(CCCCCCCCCCCCCCCCC)=O)CC(S(=O)([O-])=O)C([O-])=O.[Na+].[Na+]
InChl:
InChI=1S/C24H45NO8S.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)25-18-19-33-23(27)20-21(24(28)29)34(30,31)32;;/h21H,2-20H2,1H3,(H,25,26)(H,28,29)(H,30,31,32);;/q;2*+1/p-2
Structural formula:
Chemical structure