Chemical Compound

Pentagalloylglucose

Pentagalloylglucose chemical structure
Primary Record

Pentagalloylglucose

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
446509
SMILES
C1=C(C=C(C(=C1O)O)O)C(=O)OC[C@H]2[C@H]([C@@H]([C@@H]([C@@H](O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O
Canonical SMILES
O=C(OC[C@@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1

Names & Synonyms

  • Pentagalloylglucose
  • RefChem:1079567
  • AC1L9JR6
  • 1,2,3,4,6-Pentagalloylglucose
  • CID446509
  • ZINC169301047
  • DB03208
  • PD059955
  • BETA-1,2,3,4,6-PENTA-O-GALLOYL-D-GLUCOPYRANOSE
  • NS00073481
  • 1,2,3,4,6-pentakis-O-[(3,4,5-trihydroxyphenyl)carbonyl]-alpha-L-gulopyranose
  • ((2S,3R,4S,5S,6S)-3,4,5,6-tetrakis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl)methyl 3,4,5-trihydroxybenzoate
  • [(2S,3R,4S,5S,6S)-3,4,5,6-tetrakis[(3,4,5-trihydroxybenzoyl)oxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
  • [(2S,3R,4S,5S,6S)-3,4,5,6-tetrakis[(3,4,5-trihydroxybenzoyl)oxy]tetrahydropyran-2-yl]methyl 3,4,5-trihydroxybenzoate
  • GGP