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Reference substances

Reference substances

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General information

Inventory

EC number:
251-306-8
EC name:
Pendecamaine
CAS number:
32954-43-1

No inventory information available

Reference substance information

IUPAC name:
{dimethyl[3-(palmitoylamino)propyl]ammonio}acetate
Synonyms
Names:
1-Propanaminium, N-(carboxymethyl)-N,N-dimethyl-3-[(1-oxohexadecyl)amino]-, inner salt

CAS information

CAS number:
32954-43-1

Molecular and structural information

Molecular formula:
C23H46N2O3
Molecular weight:
398.623
SMILES notation:
CCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]
InChl:
InChI=1/C23H46N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-22(26)24-19-17-20-25(2,3)21-23(27)28/h4-21H2,1-3H3,(H-,24,26,27,28)
Structural formula:
Chemical structure