Glycoside
GD007653
Name:
NoneFormula:
C23H34O12N2Smiles:
Nc1ccccc1CN1CC[C@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)C1=OAglycone:
Nc1ccccc1CN1CCC(O)C1=OSugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.7 |
| AlogP: | -3.99 | Num_rotatable_bonds: | 8 |
| MolWt: | 530.53 | Num_heavy_atoms: | 37 |
| TPSA: | 224.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD06206
Formula: C11H14O2N2
Smiles:
Nc1ccccc1CN1CCC(O)C1=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 206.24 | Num_heavy_atoms: | 15 |
| TPSA: | 66.56 | NumAromaticRings: | 1 |
