potassium [(2R,3S,4S,5R,6S)-6-[3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-oxidanyl-phenoxy]-3,4,5-tris(oxidanyl)oxan-2-yl]methyl sulfate

Systemtic Name: potassium [(2R,3S,4S,5R,6S)-6-[3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-oxidanyl-phenoxy]-3,4,5-tris(oxidanyl)oxan-2-yl]methyl sulfate Openeye Name: potassium [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)vinyl]phenoxy]tetrahydropyran-2-yl]methyl sulfate CAS Name: potassium [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-2-oxanyl]methyl sulfate IUPAC Name: potassium [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]oxan-2-yl]methyl sulfate Traditional Name: potassium [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)vinyl]phenoxy]tetrahydropyran-2-yl]methyl sulfate Formula: C20H21KO11S MolecularWeight: 508.53744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)COS(=O)(=O)[O-])O)O)O)O)O.[K+]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=CC(=CC(=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COS(=O)(=O)[O-])O)O)O)O)O.[K+]

InChI

InChI=1S/C20H22O11S.K/c21-13-5-3-11(4-6-13)1-2-12-7-14(22)9-15(8-12)30-20-19(25)18(24)17(23)16(31-20)10-29-32(26,27)28;/h1-9,16-25H,10H2,(H,26,27,28);/q;+1/p-1/b2-1+;/t16-,17-,18+,19-,20-;/m1./s1