Glycoside
GD026887
Name:
NoneFormula:
C17H20O7N2Smiles:
Cc1ccc2ccc(C(=O)N[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(O)c2n1Aglycone:
Cc1ccc2ccc(C(N)=O)c(O)c2n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 364.35 | Num_heavy_atoms: | 26 |
| TPSA: | 152.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD05068
Formula: C11H10O2N2
Smiles:
Cc1ccc2ccc(C(N)=O)c(O)c2n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.09 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 1 |
| MolWt: | 202.21 | Num_heavy_atoms: | 15 |
| TPSA: | 76.21 | NumAromaticRings: | 2 |
