6-azanyl-2-[[6-azanyl-2-[2,6-bis(azanyl)hexanoylamino]hexanoyl]-hexadecanoyl-amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[6-azanyl-2-[2,6-bis(azanyl)hexanoylamino]hexanoyl]-hexadecanoyl-amino]hexanoic acid Openeye Name: 6-amino-2-[[6-amino-2-(2,6-diaminohexanoylamino)hexanoyl]-hexadecanoyl-amino]hexanoic acid CAS Name: 6-amino-2-[[6-amino-2-[(2,6-diamino-1-oxohexyl)amino]-1-oxohexyl]-(1-oxohexadecyl)amino]hexanoic acid IUPAC Name: 6-amino-2-[[6-amino-2-(2,6-diaminohexanoylamino)hexanoyl]-hexadecanoylamino]hexanoic acid Traditional Name: 6-amino-2-[[6-amino-2-(2,6-diaminohexanoylamino)hexanoyl]-hexadecanoyl-amino]hexanoic acid Formula: C34H68N6O5 MolecularWeight: 640.94092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H68N6O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-24-31(41)40(30(34(44)45)23-17-20-27-37)33(43)29(22-16-19-26-36)39-32(42)28(38)21-15-18-25-35/h28-30H,2-27,35-38H2,1H3,(H,39,42)(H,44,45)