Glycoside
GD147807
Name:
6'-O-CyclopropanoyltheviridosideFormula:
C21H28O12Smiles:
COC(=O)C1=COC(OC2OC(COC(=O)C3CC3)C(O)C(O)C2O)C2C(CO)=CCC12OAglycone:
COC(=O)C1=COC(O)C2C(CO)=CCC12O.COC(=O)C1CC1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 7 |
| MolWt: | 472.44 | Num_heavy_atoms: | 33 |
| TPSA: | 181.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD45331
Formula: C11H14O6
Smiles:
COC(=O)C1=COC(O)C2C(CO)=CCC12O| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 242.23 | Num_heavy_atoms: | 17 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
AD59175
Formula: C5H8O2
Smiles:
COC(=O)C1CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.8 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 100.12 | Num_heavy_atoms: | 7 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
