Glycoside
GD116213
Name:
Pinobanksin 5-Galactosyl-(1->4)-GlucosideFormula:
C27H32O15Smiles:
O=C1c2c(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)cc(O)cc2OC(c2ccccc2)C1OAglycone:
O=C1c2c(O)cc(O)cc2OC(c2ccccc2)C1OSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.52 |
| AlogP: | -2.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 596.54 | Num_heavy_atoms: | 42 |
| TPSA: | 245.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD46108
Formula: C15H12O5
Smiles:
O=C1c2c(O)cc(O)cc2OC(c2ccccc2)C1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
