Showing chemical card for 6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid (CFc000134021)
6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid belongs to the class of organic compounds known as hydrolyzable tannins. These are tannins with a structure characterized by either of the following models. In model 1, the structure contains galloyl units (in some cases, shikimic acid units) that are linked to diverse polyol carbohydrate-, catechin-, or triterpenoid units. In model 2, contains at least two galloyl units C-C coupled to each other, and do not contain a glycosidically linked catechin unit. Based on a literature review very few articles have been published on 6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid.
MOL for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
3D MOL for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
3D SDF for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
3D-SDF for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
PDB for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
3D PDB for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
SMILES for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
INCHI for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
Structure for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
3D Structure for CFc000134021 (6-{5-[({4-[(2-aminoethyl)sulfanyl]-2-(1,3-dihydroxy-4-oxocyclohexa-2,5-dien-1-yl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl}oxy)carbonyl]-2,3-dihydroxyphenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid)
Belongs to the class of organic compounds known as hydrolyzable tannins. These are tannins with a structure characterized by either of the following models. In model 1, the structure contains galloyl units (in some cases, shikimic acid units) that are linked to diverse polyol carbohydrate-, catechin-, or triterpenoid units. In model 2, contains at least two galloyl units C-C coupled to each other, and do not contain a glycosidically linked catechin unit.
