(2R)-N-[(2S,3R)-1,3-bis(oxidanyl)octadecan-2-yl]-2-oxidanyl-icosanamide

Systemtic Name: (2R)-N-[(2S,3R)-1,3-bis(oxidanyl)octadecan-2-yl]-2-oxidanyl-icosanamide Openeye Name: (2R)-2-hydroxy-N-[(1S,2R)-2-hydroxy-1-(hydroxymethyl)heptadecyl]icosanamide CAS Name: (2R)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]-2-hydroxyeicosanamide IUPAC Name: (2R)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]-2-hydroxyicosanamide Traditional Name: (2R)-2-hydroxy-N-[(1S,2R)-2-hydroxy-1-methylol-heptadecyl]arachidamide Formula: C38H77NO4 MolecularWeight: 612.02228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[C@H](C(=O)N[C@@H](CO)[C@@H](CCCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C38H77NO4/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-37(42)38(43)39-35(34-40)36(41)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h35-37,40-42H,3-34H2,1-2H3,(H,39,43)/t35-,36+,37+/m0/s1