Glycoside
GD075447
Name:
NoneFormula:
C18H22O7N2Smiles:
Cc1c(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)c2ccccc2n1CAglycone:
Cc1c(C(N)=O)c(=O)c2ccccc2n1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 378.38 | Num_heavy_atoms: | 27 |
| TPSA: | 141.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD34955
Formula: C12H12O2N2
Smiles:
Cc1c(C(N)=O)c(=O)c2ccccc2n1C| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 216.24 | Num_heavy_atoms: | 16 |
| TPSA: | 65.09 | NumAromaticRings: | 2 |
