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

Systemtic Name: N-[3-(2-azanylpropanoylamino)-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]-N-octadecyl-octadecanamide Openeye Name: N-[3-(2-aminopropanoylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-N-octadecyl-octadecanamide CAS Name: N-[3-[(2-amino-1-oxopropyl)amino]-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]-N-octadecyloctadecanamide IUPAC Name: N-[3-(2-aminopropanoylamino)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-N-octadecyloctadecanamide Traditional Name: N-[3-(alanylamino)-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]-N-stearyl-stearamide Formula: C45H89N3O6 MolecularWeight: 768.20466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)CO)O)O)NC(=O)C(C)N)C(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)CO)O)O)NC(=O)C(C)N)C(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C45H89N3O6/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-48(45-41(47-44(53)38(3)46)43(52)42(51)39(37-49)54-45)40(50)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h38-39,41-43,45,49,51-52H,4-37,46H2,1-3H3,(H,47,53)