6-azanyl-2-[2,3-bis(hexadecanoylamino)propanoylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[2,3-bis(hexadecanoylamino)propanoylamino]hexanoic acid Openeye Name: 6-amino-2-[2,3-bis(hexadecanoylamino)propanoylamino]hexanoic acid CAS Name: 6-amino-2-[[1-oxo-2,3-bis(1-oxohexadecylamino)propyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[2,3-bis(hexadecanoylamino)propanoylamino]hexanoic acid Traditional Name: 6-amino-2-(2,3-dipalmitamidopropanoylamino)hexanoic acid Formula: C41H80N4O5 MolecularWeight: 709.0977

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NCC(C(=O)NC(CCCCN)C(=O)O)NC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NCC(C(=O)NC(CCCCN)C(=O)O)NC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C41H80N4O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32-38(46)43-35-37(40(48)45-36(41(49)50)31-29-30-34-42)44-39(47)33-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36-37H,3-35,42H2,1-2H3,(H,43,46)(H,44,47)(H,45,48)(H,49,50)