Glycoside
GD126539
Name:
NoneFormula:
C28H34O14Smiles:
COc1ccc(C=CC(=O)c2c(O)cc(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)cc2O)cc1Aglycone:
COc1ccc(C=CC(=O)c2c(O)cc(O)cc2O)cc1Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.46 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 9 |
| MolWt: | 594.57 | Num_heavy_atoms: | 42 |
| TPSA: | 225.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD51214
Formula: C16H14O5
Smiles:
COc1ccc(C=CC(=O)c2c(O)cc(O)cc2O)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 286.28 | Num_heavy_atoms: | 21 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
