Glycoside
GD120177
Name:
NoneFormula:
C28H34O16Smiles:
COc1cc(C2=C(OC3OC(CO)C(O)C(O)C3O)C=C3[C](C=C(O)C=C3OC3OC(CO)C(O)C(O)C3O)[OH+]2)ccc1OAglycone:
COc1cc(C2=C(O)C=C3C(O)=CC(O)=CC3[OH+]2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 11 | FractionCSP3: | 0.46 |
| AlogP: | -2.39 | Num_rotatable_bonds: | 8 |
| MolWt: | 626.56 | Num_heavy_atoms: | 44 |
| TPSA: | 261.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD45539
Formula: C16H15O6
Smiles:
COc1cc(C2=C(O)C=C3C(O)=CC(O)=CC3[OH+]2)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.12 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 303.29 | Num_heavy_atoms: | 22 |
| TPSA: | 102.95 | NumAromaticRings: | 1 |
