Glycoside
GD022152
Name:
NoneFormula:
C40H44O14Smiles:
O=C(O)Cc1cccc(-c2cc(CCc3cccc(-c4ccccc4O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c3)ccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
O=C(O)Cc1cccc(-c2cc(CCc3cccc(-c4ccccc4O)c3)ccc2O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 9 | FractionCSP3: | 0.38 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 13 |
| MolWt: | 748.78 | Num_heavy_atoms: | 54 |
| TPSA: | 236.06 | NumAromaticRings: | 4 |
Unique Aglycone
AD15054
Formula: C28H24O4
Smiles:
O=C(O)Cc1cccc(-c2cc(CCc3cccc(-c4ccccc4O)c3)ccc2O)c1| HBA: | 4 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 5.84 | Num_rotatable_bonds: | 7 |
| MolWt: | 424.5 | Num_heavy_atoms: | 32 |
| TPSA: | 77.76 | NumAromaticRings: | 4 |
