Glycoside
GD121155
Name:
VolubilinFormula:
C23H24O9Smiles:
COc1ccc(-c2coc3c(C4OC(C)C(O)C(O)C4O)c(OC)cc(O)c3c2=O)cc1Aglycone:
COc1ccc(-c2coc3cc(OC)cc(O)c3c2=O)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 4 |
| MolWt: | 444.44 | Num_heavy_atoms: | 32 |
| TPSA: | 138.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD06665
Formula: C17H14O5
Smiles:
COc1ccc(-c2coc3cc(OC)cc(O)c3c2=O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 3.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
