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Reference substances

Reference substances

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General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
N-(3-ammoniopropyl)-N'-(3-{[3-(octadecylammonio)propyl]ammonio}propyl)propane-1,3-diaminium pentaacetate

Molecular and structural information

Molecular formula:
C40H87N5O10
Molecular weight:
ca. 798.15
SMILES notation:
CCCCCCCCCCCCCCCCCC[NH2+]CCC[NH2+]CCC[NH2+]CCC[NH2+]CCC[NH3+].CC([O-])=O.CC([O-])=O.CC([O-])=O.CC([O-])=O.CC([O-])=O
InChl:
InChI=1S/C30H67N5.5C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-32-25-19-27-34-29-21-30-35-28-20-26-33-24-18-22-31;5*1-2(3)4/h32-35H,2-31H2,1H3;5*1H3,(H,3,4)
Structural formula:
Chemical structure