3-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-naphthalene-1,2-dione CAS Name: 4-hydroxy-3-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]naphthalene-1,2-dione IUPAC Name: 4-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalene-1,2-dione Traditional Name: 4-hydroxy-3-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-1,2-naphthoquinone Formula: C16H16O9 MolecularWeight: 352.29284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=O)C2=O)OC3C(C(C(C(O3)CO)O)O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=O)C2=O)OC3C(C(C(C(O3)CO)O)O)O)O

InChI

InChI=1S/C16H16O9/c17-5-8-11(20)12(21)14(23)16(24-8)25-15-10(19)7-4-2-1-3-6(7)9(18)13(15)22/h1-4,8,11-12,14,16-17,19-21,23H,5H2