Glycoside
GD021841
Name:
NoneFormula:
C24H24O7N2Smiles:
O=C(Nc1ccncc1)c1cccc(-c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)c1Aglycone:
O=C(Nc1ccncc1)c1cccc(-c2ccc(O)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 452.46 | Num_heavy_atoms: | 33 |
| TPSA: | 141.37 | NumAromaticRings: | 3 |
Unique Aglycone
AD14871
Formula: C18H14O2N2
Smiles:
O=C(Nc1ccncc1)c1cccc(-c2ccc(O)cc2)c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 290.32 | Num_heavy_atoms: | 22 |
| TPSA: | 62.22 | NumAromaticRings: | 3 |
