Glycoside
GD124544
Name:
5-Galloylquercetin-3-O-Alpha-L-ArabinofuranosideFormula:
C27H22O14Smiles:
O=C(c1cc(O)c(O)c(O)c1)c1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(OC3OC(CO)C(O)C3O)c(=O)c12Aglycone:
O=C(c1cc(O)c(O)c(O)c1)c1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.19 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 6 |
| MolWt: | 570.46 | Num_heavy_atoms: | 41 |
| TPSA: | 247.81 | NumAromaticRings: | 4 |
Unique Aglycone
AD50319
Formula: C22H14O10
Smiles:
O=C(c1cc(O)c(O)c(O)c1)c1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.0 |
| AlogP: | 2.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 438.34 | Num_heavy_atoms: | 32 |
| TPSA: | 188.89 | NumAromaticRings: | 4 |
