8-(4-fluorophenyl)-N-[(2R,3S,4R)-1-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-3,4-bis(oxidanyl)octadecan-2-yl]octanamide

Systemtic Name: 8-(4-fluorophenyl)-N-[(2R,3S,4R)-1-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-3,4-bis(oxidanyl)octadecan-2-yl]octanamide Openeye Name: N-[(1R,2S,3R)-2,3-dihydroxy-1-[[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]methyl]heptadecyl]-8-(4-fluorophenyl)octanamide CAS Name: N-[(2R,3S,4R)-3,4-dihydroxy-1-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]octadecan-2-yl]-8-(4-fluorophenyl)octanamide IUPAC Name: N-[(2R,3S,4R)-3,4-dihydroxy-1-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]octadecan-2-yl]-8-(4-fluorophenyl)octanamide Traditional Name: N-[(1R,2S,3R)-2,3-dihydroxy-1-[[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]methyl]heptadecyl]-8-(4-fluorophenyl)caprylamide Formula: C38H66FNO8 MolecularWeight: 683.930943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C(CC1C(C(C(C(O1)CO)O)O)O)NC(=O)CCCCCCCC2=CC=C(C=C2)F)O)O

Isomeric SMILES

CCCCCCCCCCCCCC[C@H]([C@H]([C@@H](C[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)NC(=O)CCCCCCCC2=CC=C(C=C2)F)O)O

InChI

InChI=1S/C38H66FNO8/c1-2-3-4-5-6-7-8-9-10-11-14-17-20-31(42)35(44)30(26-32-36(45)38(47)37(46)33(27-41)48-32)40-34(43)21-18-15-12-13-16-19-28-22-24-29(39)25-23-28/h22-25,30-33,35-38,41-42,44-47H,2-21,26-27H2,1H3,(H,40,43)/t30-,31-,32-,33-,35+,36+,37+,38-/m1/s1