2-azanyloctadecane-1,3,4-triol; 2-oxidanylhexacosanoic acid

Systemtic Name: 2-azanyloctadecane-1,3,4-triol; 2-oxidanylhexacosanoic acid Openeye Name: 2-aminooctadecane-1,3,4-triol; 2-hydroxyhexacosanoic acid CAS Name: 2-aminooctadecane-1,3,4-triol; 2-hydroxyhexacosanoic acid IUPAC Name: 2-aminooctadecane-1,3,4-triol; 2-hydroxyhexacosanoic acid Traditional Name: 2-aminooctadecane-1,3,4-triol; 2-hydroxycerotic acid Formula: C44H91NO6 MolecularWeight: 730.19644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)O)O.CCCCCCCCCCCCCCC(C(C(CO)N)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)O)O.CCCCCCCCCCCCCCC(C(C(CO)N)O)O

InChI

InChI=1S/C26H52O3.C18H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(27)26(28)29;1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h25,27H,2-24H2,1H3,(H,28,29);16-18,20-22H,2-15,19H2,1H3