Glycoside
GD000851
Name:
NoneFormula:
C25H30O11Smiles:
CC=C(C)C(=O)O[C@@H]1c2c(ccc3ccc(=O)oc23)OC(C)(C)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
CC=C(C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 5 |
| MolWt: | 506.5 | Num_heavy_atoms: | 36 |
| TPSA: | 165.12 | NumAromaticRings: | 2 |
Unique Aglycone
AD00888
Formula: C19H20O6
Smiles:
CC=C(C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.37 |
| AlogP: | 2.88 | Num_rotatable_bonds: | 2 |
| MolWt: | 344.36 | Num_heavy_atoms: | 25 |
| TPSA: | 85.97 | NumAromaticRings: | 2 |
