Glycoside
GD123595
Name:
NoneFormula:
C26H28O12Smiles:
COc1cc(C2=C(OC3OC(CO)C(O)C(O)C3O)C3=C4[C](C=C(O)C=C4[OH+]2)OC(C)=C3)cc(OC)c1OAglycone:
COc1cc(C2=C(O)C3=C4C(=CC(O)=CC4OC(C)=C3)[OH+]2)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.35 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 532.5 | Num_heavy_atoms: | 38 |
| TPSA: | 180.33 | NumAromaticRings: | 1 |
Unique Aglycone
AD45899
Formula: C20H19O7
Smiles:
COc1cc(C2=C(O)C3=C4C(=CC(O)=CC4OC(C)=C3)[OH+]2)cc(OC)c1O| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.2 |
| AlogP: | 3.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 371.37 | Num_heavy_atoms: | 27 |
| TPSA: | 101.18 | NumAromaticRings: | 1 |
