Glycoside
GD115043
Name:
Aristofolin AFormula:
C23H22O11Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)cc2c1ccc1c(C(=O)O)cc3c(c12)OCO3Aglycone:
COc1cc(O)cc2c1ccc1c(C(=O)O)cc3c(c12)OCO3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 474.42 | Num_heavy_atoms: | 34 |
| TPSA: | 164.37 | NumAromaticRings: | 3 |
Unique Aglycone
AD45440
Formula: C17H12O6
Smiles:
COc1cc(O)cc2c1ccc1c(C(=O)O)cc3c(c12)OCO3| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 3.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 312.28 | Num_heavy_atoms: | 23 |
| TPSA: | 85.22 | NumAromaticRings: | 3 |
