zinc (2S)-2-azanyl-6-(hexadecanoylamino)hexanoate

Systemtic Name: zinc (2S)-2-azanyl-6-(hexadecanoylamino)hexanoate Openeye Name: zinc (2S)-2-amino-6-(hexadecanoylamino)hexanoate CAS Name: zinc (2S)-2-amino-6-(1-oxohexadecylamino)hexanoate IUPAC Name: zinc (2S)-2-amino-6-(hexadecanoylamino)hexanoate Traditional Name: zinc (2S)-2-amino-6-palmitamido-hexanoate Formula: C44H86N4O6Zn MolecularWeight: 832.58584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NCCCCC(C(=O)[O-])N.CCCCCCCCCCCCCCCC(=O)NCCCCC(C(=O)[O-])N.[Zn+2]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NCCCC[C@@H](C(=O)[O-])N.CCCCCCCCCCCCCCCC(=O)NCCCC[C@@H](C(=O)[O-])N.[Zn+2]

InChI

InChI=1S/2C22H44N2O3.Zn/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21(25)24-19-16-15-17-20(23)22(26)27;/h2*20H,2-19,23H2,1H3,(H,24,25)(H,26,27);/q;;+2/p-2/t2*20-;/m00./s1