Glycoside
GD016089
Name:
NoneFormula:
C22H22O14Smiles:
Cc1cc(O)c(C(=O)O)c2c1C(=O)c1c(O)c(OCC(O)C(O)C(O)C(O)CO)c(O)c(O)c1C2=OAglycone:
Cc1cc(O)c(C(=O)O)c2c1C(=O)c1c(O)cc(O)c(O)c1C2=OSugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.32 |
| AlogP: | -1.89 | Num_rotatable_bonds: | 8 |
| MolWt: | 510.4 | Num_heavy_atoms: | 36 |
| TPSA: | 262.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD11622
Formula: C16H10O8
Smiles:
Cc1cc(O)c(C(=O)O)c2c1C(=O)c1c(O)cc(O)c(O)c1C2=O| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.06 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 1 |
| MolWt: | 330.25 | Num_heavy_atoms: | 24 |
| TPSA: | 152.36 | NumAromaticRings: | 2 |
