N-[3-(2-azanylpropanoylamino)-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]-N-hexadecyl-octadecanamide

Systemtic Name: N-[3-(2-azanylpropanoylamino)-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]-N-hexadecyl-octadecanamide Openeye Name: N-[3-(2-aminopropanoylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-N-hexadecyl-octadecanamide CAS Name: N-[3-[(2-amino-1-oxopropyl)amino]-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]-N-hexadecyloctadecanamide IUPAC Name: N-[3-(2-aminopropanoylamino)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-N-hexadecyloctadecanamide Traditional Name: N-[3-(alanylamino)-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]-N-cetyl-stearamide Formula: C43H85N3O6 MolecularWeight: 740.1515

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)N(CCCCCCCCCCCCCCCC)C1C(C(C(C(O1)CO)O)O)NC(=O)C(C)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N(CCCCCCCCCCCCCCCC)C1C(C(C(C(O1)CO)O)O)NC(=O)C(C)N

InChI

InChI=1S/C43H85N3O6/c1-4-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-38(48)46(34-32-30-28-26-24-22-19-17-15-13-11-9-7-5-2)43-39(45-42(51)36(3)44)41(50)40(49)37(35-47)52-43/h36-37,39-41,43,47,49-50H,4-35,44H2,1-3H3,(H,45,51)