Glycoside
GD115933
Name:
NoneFormula:
C21H23O10Smiles:
COc1cc(C2=C(OC3OCC(O)C(O)C3O)C=C3C=CC([OH2+])=CC3O2)cc(O)c1OAglycone:
COc1cc(C2=C(O)C=C3C=CC([OH2+])=CC3O2)cc(O)c1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 435.41 | Num_heavy_atoms: | 31 |
| TPSA: | 160.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD45946
Formula: C16H15O6
Smiles:
COc1cc(C2=C(O)C=C3C=CC([OH2+])=CC3O2)cc(O)c1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.12 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 303.29 | Num_heavy_atoms: | 22 |
| TPSA: | 102.05 | NumAromaticRings: | 1 |
