Glycoside
GD000264
Name:
HomoarbutinFormula:
C13H18O7Smiles:
Cc1cc(OC2OC(CO)C(O)C(O)C2O)ccc1OAglycone:
Cc1cc(O)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 286.28 | Num_heavy_atoms: | 20 |
| TPSA: | 119.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD00307
Formula: C7H8O2
Smiles:
Cc1cc(O)ccc1O| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 0 |
| MolWt: | 124.14 | Num_heavy_atoms: | 9 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
