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

Systemtic Name: N-[3-[2-[2,6-bis(azanyl)hexanoylamino]propanoylamino]-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]-N-octadecyl-octadecanamide Openeye Name: N-[3-[2-(2,6-diaminohexanoylamino)propanoylamino]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-N-octadecyl-octadecanamide CAS Name: N-[3-[[2-[(2,6-diamino-1-oxohexyl)amino]-1-oxopropyl]amino]-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]-N-octadecyloctadecanamide IUPAC Name: N-[3-[2-(2,6-diaminohexanoylamino)propanoylamino]-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-N-octadecyloctadecanamide Traditional Name: N-[3-[2-(2,6-diaminohexanoylamino)propanoylamino]-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]-N-stearyl-stearamide Formula: C51H101N5O7 MolecularWeight: 896.37694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C51H101N5O7/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-36-40-56(45(58)38-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2)51-46(48(60)47(59)44(41-57)63-51)55-49(61)42(3)54-50(62)43(53)37-34-35-39-52/h42-44,46-48,51,57,59-60H,4-41,52-53H2,1-3H3,(H,54,62)(H,55,61)