4-(hydroxymethyl)-6-(octadecylamino)cyclohex-4-ene-1,2,3-triol

Systemtic Name: 4-(hydroxymethyl)-6-(octadecylamino)cyclohex-4-ene-1,2,3-triol Openeye Name: 4-(hydroxymethyl)-6-(octadecylamino)cyclohex-4-ene-1,2,3-triol CAS Name: 4-(hydroxymethyl)-6-(octadecylamino)cyclohex-4-ene-1,2,3-triol IUPAC Name: 4-(hydroxymethyl)-6-(octadecylamino)cyclohex-4-ene-1,2,3-triol Traditional Name: 4-methylol-6-(stearylamino)cyclohex-4-ene-1,2,3-triol Formula: C25H49NO4 MolecularWeight: 427.66086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1C=C(C(C(C1O)O)O)CO

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1C=C(C(C(C1O)O)O)CO

InChI

InChI=1S/C25H49NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-22-19-21(20-27)23(28)25(30)24(22)29/h19,22-30H,2-18,20H2,1H3