Glycoside
GD147526
Name:
NoneFormula:
C21H22O9Smiles:
OCc1cc(O)c2c(O)c3c(O)cccc3c(C3OC(CO)C(O)C(O)C3O)c2c1Aglycone:
OCc1cc(O)c2c(O)c3c(O)cccc3cc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.33 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 418.4 | Num_heavy_atoms: | 30 |
| TPSA: | 171.07 | NumAromaticRings: | 3 |
Unique Aglycone
AD59075
Formula: C15H12O4
Smiles:
OCc1cc(O)c2c(O)c3c(O)cccc3cc2c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 2.6 | Num_rotatable_bonds: | 1 |
| MolWt: | 256.26 | Num_heavy_atoms: | 19 |
| TPSA: | 80.92 | NumAromaticRings: | 3 |
