5-(3-hexadecanoyloxyoctadecanoylamino)pentanoic acid

Systemtic Name: 5-(3-hexadecanoyloxyoctadecanoylamino)pentanoic acid Openeye Name: 5-(3-hexadecanoyloxyoctadecanoylamino)pentanoic acid CAS Name: 5-[[1-oxo-3-(1-oxohexadecoxy)octadecyl]amino]pentanoic acid IUPAC Name: 5-(3-hexadecanoyloxyoctadecanoylamino)pentanoic acid Traditional Name: 5-(3-hexadecanoyloxyoctadecanoylamino)valeric acid Formula: C39H75NO5 MolecularWeight: 638.0165

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC(=O)NCCCCC(=O)O)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC(=O)NCCCCC(=O)O)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C39H75NO5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-36(35-37(41)40-34-30-29-32-38(42)43)45-39(44)33-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36H,3-35H2,1-2H3,(H,40,41)(H,42,43)