4-oxidanylidene-4-(tetradecylamino)-3-[3,6,9-tris(oxidanyl)hexadecanoylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-(tetradecylamino)-3-[3,6,9-tris(oxidanyl)hexadecanoylamino]butanoic acid Openeye Name: 4-oxo-4-(tetradecylamino)-3-(3,6,9-trihydroxyhexadecanoylamino)butanoic acid CAS Name: 4-oxo-4-(tetradecylamino)-3-[(3,6,9-trihydroxy-1-oxohexadecyl)amino]butanoic acid IUPAC Name: 4-oxo-4-(tetradecylamino)-3-(3,6,9-trihydroxyhexadecanoylamino)butanoic acid Traditional Name: 4-keto-4-(myristylamino)-3-(3,6,9-trihydroxyhexadecanoylamino)butyric acid Formula: C34H66N2O7 MolecularWeight: 614.89704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCNC(=O)C(CC(=O)O)NC(=O)CC(CCC(CCC(CCCCCCC)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCNC(=O)C(CC(=O)O)NC(=O)CC(CCC(CCC(CCCCCCC)O)O)O

InChI

InChI=1S/C34H66N2O7/c1-3-5-7-9-10-11-12-13-14-15-17-19-25-35-34(43)31(27-33(41)42)36-32(40)26-30(39)24-23-29(38)22-21-28(37)20-18-16-8-6-4-2/h28-31,37-39H,3-27H2,1-2H3,(H,35,43)(H,36,40)(H,41,42)