Primary Record
Pentagalloylglucose
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 11593217
- 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
- CHEMBL207014
- SCHEMBL2227915
- BDBM175528
- CID11593217
- US9120744, CDE-004
- J2.582.159I
- 1,2,3,4,6-penta-O-galloyl-beta-d-glu-cose
- 1-O,2-O,3-O,4-O,6-O-Pentagalloyl-beta-D-galactopyranose
- [(2R,3S,4S,5R,6S)-3,4,5,6-tetrakis(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate