Glycoside
GD085971
Name:
NoneFormula:
C22H29O7NSmiles:
COc1cc(CN[C@H]2[C@H](O)[C@@H](OCc3ccccc3)OC[C@@H]2O)cc(OC)c1OCAglycone:
COc1cc(CN)cc(OC)c1OC.OCc1ccccc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 9 |
| MolWt: | 419.47 | Num_heavy_atoms: | 30 |
| TPSA: | 98.64 | NumAromaticRings: | 2 |
Unique Aglycone
AD00044
Formula: C7H8O
Smiles:
OCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
AD38247
Formula: C10H15O3N
Smiles:
COc1cc(CN)cc(OC)c1OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 197.23 | Num_heavy_atoms: | 14 |
| TPSA: | 53.71 | NumAromaticRings: | 1 |
