N-[(2S,3R,4S)-1,3,4-tris(oxidanyl)octadecan-2-yl]pentanamide

Systemtic Name: N-[(2S,3R,4S)-1,3,4-tris(oxidanyl)octadecan-2-yl]pentanamide Openeye Name: N-[(1S,2R,3S)-2,3-dihydroxy-1-(hydroxymethyl)heptadecyl]pentanamide CAS Name: N-[(2S,3R,4S)-1,3,4-trihydroxyoctadecan-2-yl]pentanamide IUPAC Name: N-[(2S,3R,4S)-1,3,4-trihydroxyoctadecan-2-yl]pentanamide Traditional Name: N-[(1S,2R,3S)-2,3-dihydroxy-1-methylol-heptadecyl]valeramide Formula: C23H47NO4 MolecularWeight: 401.62358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C(CO)NC(=O)CCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCC[C@@H]([C@@H]([C@H](CO)NC(=O)CCCC)O)O

InChI

InChI=1S/C23H47NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-21(26)23(28)20(19-25)24-22(27)18-6-4-2/h20-21,23,25-26,28H,3-19H2,1-2H3,(H,24,27)/t20-,21-,23+/m0/s1