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6-azanylhexanoic acid; 2-(octadecanoylamino)ethanoic acid

6-azanylhexanoic acid; 2-(octadecanoylamino)ethanoic acid

Systemtic Name:6-azanylhexanoic acid; 2-(octadecanoylamino)ethanoic acid
Openeye Name:6-aminohexanoic acid; 2-(octadecanoylamino)acetic acid
CAS Name:6-aminohexanoic acid; 2-(1-oxooctadecylamino)acetic acid
IUPAC Name:6-aminohexanoic acid; 2-(octadecanoylamino)acetic acid
Traditional Name:6-aminohexanoic acid; 2-stearamidoacetic acid
Formula: C26H52N2O5
MolecularWeight: 472.70148
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC(=O)O.C(CCC(=O)O)CCN


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC(=O)O.C(CCC(=O)O)CCN


InChI

InChI=1S/C20H39NO3.C6H13NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24;7-5-3-1-2-4-6(8)9/h2-18H2,1H3,(H,21,22)(H,23,24);1-5,7H2,(H,8,9)


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