(Z,2S,3R,4R)-3-ethenyl-8-(3-hydroxyphenyl)-7-pyridin-2-yl-oct-7-ene-1,2,4-triol

Systemtic Name: (Z,2S,3R,4R)-3-ethenyl-8-(3-hydroxyphenyl)-7-pyridin-2-yl-oct-7-ene-1,2,4-triol Openeye Name: (Z,2S,3R,4R)-8-(3-hydroxyphenyl)-7-(2-pyridyl)-3-vinyl-oct-7-ene-1,2,4-triol CAS Name: (Z,2S,3R,4R)-3-ethenyl-8-(3-hydroxyphenyl)-7-(2-pyridinyl)-7-octene-1,2,4-triol IUPAC Name: (Z,2S,3R,4R)-3-ethenyl-8-(3-hydroxyphenyl)-7-pyridin-2-yloct-7-ene-1,2,4-triol Traditional Name: (Z,2S,3R,4R)-8-(3-hydroxyphenyl)-7-(2-pyridyl)-3-vinyl-oct-7-ene-1,2,4-triol Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C(CCC(=CC1=CC(=CC=C1)O)C2=CC=CC=N2)O)C(CO)O

Isomeric SMILES

C=C[C@H]([C@@H](CC/C(=C/C1=CC(=CC=C1)O)/C2=CC=CC=N2)O)[C@@H](CO)O

InChI

InChI=1S/C21H25NO4/c1-2-18(21(26)14-23)20(25)10-9-16(19-8-3-4-11-22-19)12-15-6-5-7-17(24)13-15/h2-8,11-13,18,20-21,23-26H,1,9-10,14H2/b16-12-/t18-,20-,21-/m1/s1