3-hexadecyl-1,1,1-triphenyl-icosane-2,3,4-triol

Systemtic Name: 3-hexadecyl-1,1,1-triphenyl-icosane-2,3,4-triol Openeye Name: 3-hexadecyl-1,1,1-triphenyl-icosane-2,3,4-triol CAS Name: 3-hexadecyl-1,1,1-triphenyleicosane-2,3,4-triol IUPAC Name: 3-hexadecyl-1,1,1-triphenylicosane-2,3,4-triol Traditional Name: 3-cetyl-1,1,1-triphenyl-eicosane-2,3,4-triol Formula: C54H86O3 MolecularWeight: 783.25884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCCCCCC)(C(C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(CCCCCCCCCCCCCCCC)(C(C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)O)O)O

InChI

InChI=1S/C54H86O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-38-46-51(55)53(57,47-39-28-26-24-22-20-18-16-14-12-10-8-6-4-2)52(56)54(48-40-32-29-33-41-48,49-42-34-30-35-43-49)50-44-36-31-37-45-50/h29-37,40-45,51-52,55-57H,3-28,38-39,46-47H2,1-2H3