Glycoside
GD076683
Name:
NoneFormula:
C19H20O9Smiles:
O=C1C[C@@H]2Oc3ccccc3C(O)=C2C(O)=C1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1OAglycone:
O=C1C=C(O)C2=C(O)c3ccccc3OC2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 392.36 | Num_heavy_atoms: | 28 |
| TPSA: | 156.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD35299
Formula: C13H10O4
Smiles:
O=C1C=C(O)C2=C(O)c3ccccc3OC2C1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 0 |
| MolWt: | 230.22 | Num_heavy_atoms: | 17 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
