6-azanyl-2-[3-[[6-azanyl-2-(hexadecanoylamino)hexanoyl]amino]propanoylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[3-[[6-azanyl-2-(hexadecanoylamino)hexanoyl]amino]propanoylamino]hexanoic acid Openeye Name: 6-amino-2-[3-[[6-amino-2-(hexadecanoylamino)hexanoyl]amino]propanoylamino]hexanoic acid CAS Name: 6-amino-2-[[3-[[6-amino-1-oxo-2-(1-oxohexadecylamino)hexyl]amino]-1-oxopropyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[3-[[6-amino-2-(hexadecanoylamino)hexanoyl]amino]propanoylamino]hexanoic acid Traditional Name: 6-amino-2-[3-[(6-amino-2-palmitamido-hexanoyl)amino]propanoylamino]hexanoic acid Formula: C31H61N5O5 MolecularWeight: 583.84654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CCCCN)C(=O)NCCC(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(CCCCN)C(=O)NCCC(=O)NC(CCCCN)C(=O)O

InChI

InChI=1S/C31H61N5O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-28(37)35-26(19-15-17-23-32)30(39)34-25-22-29(38)36-27(31(40)41)20-16-18-24-33/h26-27H,2-25,32-33H2,1H3,(H,34,39)(H,35,37)(H,36,38)(H,40,41)