(2R)-N-[(2S,3S,4R)-1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-15-methyl-3,4-bis(oxidanyl)heptadecan-2-yl]-2-oxidanyl-pentacosanamide

Systemtic Name: (2R)-N-[(2S,3S,4R)-1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-15-methyl-3,4-bis(oxidanyl)heptadecan-2-yl]-2-oxidanyl-pentacosanamide Openeye Name: (2R)-N-[(1S,2S,3R)-2,3-dihydroxy-14-methyl-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]hexadecyl]-2-hydroxy-pentacosanamide CAS Name: (2R)-N-[(2S,3S,4R)-3,4-dihydroxy-15-methyl-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]heptadecan-2-yl]-2-hydroxypentacosanamide IUPAC Name: (2R)-N-[(2S,3S,4R)-3,4-dihydroxy-15-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptadecan-2-yl]-2-hydroxypentacosanamide Traditional Name: (2R)-N-[(1S,2S,3R)-2,3-dihydroxy-14-methyl-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxymethyl]hexadecyl]-2-hydroxy-pentacosanamide Formula: C49H97NO10 MolecularWeight: 860.29518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C(CCCCCCCCCCC(C)CC)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCC[C@H](C(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)[C@@H]([C@@H](CCCCCCCCCCC(C)CC)O)O)O

InChI

InChI=1S/C49H97NO10/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-30-33-36-42(53)48(58)50-40(38-59-49-47(57)46(56)45(55)43(37-51)60-49)44(54)41(52)35-32-29-26-24-23-25-28-31-34-39(3)5-2/h39-47,49,51-57H,4-38H2,1-3H3,(H,50,58)/t39?,40-,41+,42+,43+,44-,45+,46-,47+,49+/m0/s1