N-[1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)undecan-2-yl]tetracosanamide

Systemtic Name: N-[1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)undecan-2-yl]tetracosanamide Openeye Name: N-[2,3-dihydroxy-1-[[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]decyl]tetracosanamide CAS Name: N-[3,4-dihydroxy-1-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]undecan-2-yl]tetracosanamide IUPAC Name: N-[3,4-dihydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyundecan-2-yl]tetracosanamide Traditional Name: N-[2,3-dihydroxy-1-[(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxymethyl]decyl]lignoceramide Formula: C41H81NO9 MolecularWeight: 732.08314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C(CCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C(CCCCCCC)O)O

InChI

InChI=1S/C41H81NO9/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-28-30-36(45)42-33(37(46)34(44)29-27-25-8-6-4-2)32-50-41-40(49)39(48)38(47)35(31-43)51-41/h33-35,37-41,43-44,46-49H,3-32H2,1-2H3,(H,42,45)