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

Systemtic Name: N-[(2R,3R)-1,3-bis(oxidanyl)octadecan-2-yl]tetracosanamide Openeye Name: N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)heptadecyl]tetracosanamide CAS Name: N-[(2R,3R)-1,3-dihydroxyoctadecan-2-yl]tetracosanamide IUPAC Name: N-[(2R,3R)-1,3-dihydroxyoctadecan-2-yl]tetracosanamide Traditional Name: N-[(1R,2R)-2-hydroxy-1-methylol-heptadecyl]lignoceramide Formula: C42H85NO3 MolecularWeight: 652.1292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C42H85NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h40-41,44-45H,3-39H2,1-2H3,(H,43,46)/t40-,41-/m1/s1