Glycoside
GD016696
Name:
5-Galloylquercetin-3-O-Alpha-L-ArabinofuranosideFormula:
C27H22O15Smiles:
O=C(Oc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c(=O)c12)c1cc(O)c(O)c(O)c1Aglycone:
O=C(Oc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12)c1cc(O)c(O)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.19 |
| AlogP: | 0.73 | Num_rotatable_bonds: | 6 |
| MolWt: | 586.46 | Num_heavy_atoms: | 42 |
| TPSA: | 257.04 | NumAromaticRings: | 4 |
Unique Aglycone
AD11986
Formula: C22H14O11
Smiles:
O=C(Oc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12)c1cc(O)c(O)c(O)c1| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.0 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 454.34 | Num_heavy_atoms: | 33 |
| TPSA: | 198.12 | NumAromaticRings: | 4 |
