Glycoside
GD001918
Name:
NoneFormula:
C38H60O14N2Smiles:
CN(CCN(C)Cc1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(C(C)(C)C)c1O)Cc1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(C(C)(C)C)c1OAglycone:
CN(CCN(C)Cc1cc(O)cc(C(C)(C)C)c1O)Cc1cc(O)cc(C(C)(C)C)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.68 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 13 |
| MolWt: | 768.9 | Num_heavy_atoms: | 54 |
| TPSA: | 245.7 | NumAromaticRings: | 2 |
Unique Aglycone
AD01866
Formula: C26H40O4N2
Smiles:
CN(CCN(C)Cc1cc(O)cc(C(C)(C)C)c1O)Cc1cc(O)cc(C(C)(C)C)c1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 4.67 | Num_rotatable_bonds: | 7 |
| MolWt: | 444.62 | Num_heavy_atoms: | 32 |
| TPSA: | 87.4 | NumAromaticRings: | 2 |
