(2R,3R,4S,5S,6R)-3-[2-[3,4-bis(oxidanyl)phenyl]-3,5-bis(oxidanyl)chromenylium-7-yl]oxy-6-(hydroxymethyl)oxane-2,4,5-triol

Systemtic Name: (2R,3R,4S,5S,6R)-3-[2-[3,4-bis(oxidanyl)phenyl]-3,5-bis(oxidanyl)chromenylium-7-yl]oxy-6-(hydroxymethyl)oxane-2,4,5-triol Openeye Name: (2R,3R,4S,5S,6R)-3-[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-chromenylium-7-yl]oxy-6-(hydroxymethyl)tetrahydropyran-2,4,5-triol CAS Name: (2R,3R,4S,5S,6R)-3-[[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-1-benzopyrylium-7-yl]oxy]-6-(hydroxymethyl)oxane-2,4,5-triol IUPAC Name: (2R,3R,4S,5S,6R)-3-[2-(3,4-dihydroxyphenyl)-3,5-dihydroxychromenylium-7-yl]oxy-6-(hydroxymethyl)oxane-2,4,5-triol Traditional Name: (2R,3R,4S,5S,6R)-3-[[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-1-benzopyrylium-7-yl]oxy]-6-methylol-tetrahydropyran-2,4,5-triol Formula: C21H21O11+ MolecularWeight: 449.38484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)OC4C(C(C(OC4O)CO)O)O)O)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O[C@@H]4[C@H]([C@@H]([C@H](O[C@H]4O)CO)O)O)O)O)O)O

InChI

InChI=1S/C21H20O11/c22-7-16-17(27)18(28)20(21(29)32-16)30-9-4-12(24)10-6-14(26)19(31-15(10)5-9)8-1-2-11(23)13(25)3-8/h1-6,16-18,20-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17-,18+,20-,21-/m1/s1