Glycoside
GD027445
Name:
NoneFormula:
C20H28O13Smiles:
COC(=O)C1=CO[C@H](O[C@@H]2O[C@H](COC=O)[C@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@H]1[C@H](O)C[C@]2(C)OC(C)=OAglycone:
COC(=O)C1=COC(O)C2C1C(O)CC2(C)OC(C)=OSugarmoiety:
O=COCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -2.28 | Num_rotatable_bonds: | 7 |
| MolWt: | 476.43 | Num_heavy_atoms: | 33 |
| TPSA: | 187.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD07054
Formula: C13H18O7
Smiles:
COC(=O)C1=COC(O)C2C1C(O)CC2(C)OC(C)=O| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.69 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 2 |
| MolWt: | 286.28 | Num_heavy_atoms: | 20 |
| TPSA: | 102.29 | NumAromaticRings: | 0 |
