Glycoside
GD024998
Name:
NoneFormula:
C24H25O7N2ClSmiles:
CN1C(=O)CN(c2ccc(Cc3cc([C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)ccc3Cl)cc2)C1=OAglycone:
CN1C(=O)CN(c2ccc(Cc3ccccc3Cl)cc2)C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 5 |
| MolWt: | 476.91 | Num_heavy_atoms: | 33 |
| TPSA: | 130.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD16624
Formula: C18H15O2N2Cl
Smiles:
CN1C(=O)CN(c2ccc(Cc3ccccc3Cl)cc2)C1=O| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.18 |
| AlogP: | 3.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.77 | Num_heavy_atoms: | 22 |
| TPSA: | 40.62 | NumAromaticRings: | 2 |
