(phenylmethyl) N-[1-[[2-[[2-[dodecanoyl(octadecyl)amino]-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[[2-[[2-[dodecanoyl(octadecyl)amino]-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-[[2-[[2-[dodecanoyl(octadecyl)amino]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[[2-[[4,5-dihydroxy-6-(hydroxymethyl)-2-[octadecyl(1-oxododecyl)amino]-3-oxanyl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[[2-[[2-[dodecanoyl(octadecyl)amino]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-[[2-[[4,5-dihydroxy-2-[lauroyl(stearyl)amino]-6-methylol-tetrahydropyran-3-yl]amino]-2-keto-ethyl]carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C52H92N4O9 MolecularWeight: 917.30828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)CO)O)O)NC(=O)CNC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)C(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)CO)O)O)NC(=O)CNC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)C(=O)CCCCCCCCCCC

InChI

InChI=1S/C52H92N4O9/c1-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-32-36-56(46(59)35-31-26-24-22-14-12-10-8-6-2)51-47(49(61)48(60)44(39-57)65-51)55-45(58)38-53-50(62)43(37-41(3)4)54-52(63)64-40-42-33-29-28-30-34-42/h28-30,33-34,41,43-44,47-49,51,57,60-61H,5-27,31-32,35-40H2,1-4H3,(H,53,62)(H,54,63)(H,55,58)