Glycoside
GD137337
Name:
NoneFormula:
C26H26O14Smiles:
COc1cc(C2=C(OC3OC(CO)C(O)C(O)C3O)C3=C[C](C(=O)O)Oc4cc(O)cc(c43)[OH+]2)cc(OC)c1OAglycone:
COc1cc(C2=C(O)C3=CC(C(=O)O)Oc4cc(O)cc(c43)[OH+]2)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.31 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 7 |
| MolWt: | 562.48 | Num_heavy_atoms: | 40 |
| TPSA: | 217.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD55379
Formula: C20H17O9
Smiles:
COc1cc(C2=C(O)C3=CC(C(=O)O)Oc4cc(O)cc(c43)[OH+]2)cc(OC)c1O| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.15 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 4 |
| MolWt: | 401.35 | Num_heavy_atoms: | 29 |
| TPSA: | 138.48 | NumAromaticRings: | 2 |
