methyl (9R,10R,12R)-9-azanyl-10,12-bis(oxidanyl)octadecanoate

Systemtic Name: methyl (9R,10R,12R)-9-azanyl-10,12-bis(oxidanyl)octadecanoate Openeye Name: methyl (9R,10R,12R)-9-amino-10,12-dihydroxy-octadecanoate CAS Name: (9R,10R,12R)-9-amino-10,12-dihydroxyoctadecanoic acid methyl ester IUPAC Name: methyl (9R,10R,12R)-9-amino-10,12-dihydroxyoctadecanoate Traditional Name: (9R,10R,12R)-9-amino-10,12-dihydroxy-stearic acid methyl ester Formula: C19H39NO4 MolecularWeight: 345.51726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(C(CCCCCCCC(=O)OC)N)O)O

Isomeric SMILES

CCCCCC[C@H](C[C@H]([C@@H](CCCCCCCC(=O)OC)N)O)O

InChI

InChI=1S/C19H39NO4/c1-3-4-5-9-12-16(21)15-18(22)17(20)13-10-7-6-8-11-14-19(23)24-2/h16-18,21-22H,3-15,20H2,1-2H3/t16-,17-,18-/m1/s1