Glycoside
GD009702
Name:
PHLOMIOLFormula:
C17H26O13Smiles:
COC(=O)C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]2[C@]1(O)[C@@H](O)[C@@H](O)[C@]2(C)OAglycone:
COC(=O)C1=COC(O)C2C(C)(O)C(O)C(O)C12OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.82 |
| AlogP: | -4.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 438.38 | Num_heavy_atoms: | 30 |
| TPSA: | 215.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD07584
Formula: C11H16O8
Smiles:
COC(=O)C1=COC(O)C2C(C)(O)C(O)C(O)C12O| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -2.77 | Num_rotatable_bonds: | 1 |
| MolWt: | 276.24 | Num_heavy_atoms: | 19 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
