Glycoside
GD104173
Name:
NoneFormula:
C26H24O4N7Smiles:
Nc1[nH+]cnc2c1c(-c1nnc(-c3ccccc3)c(-c3ccccc3)n1)cn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
Nc1[nH+]cnc2c1C(c1nnc(-c3ccccc3)c(-c3ccccc3)n1)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.19 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 5 |
| MolWt: | 498.52 | Num_heavy_atoms: | 37 |
| TPSA: | 166.57 | NumAromaticRings: | 5 |
Unique Aglycone
AD43972
Formula: C21H15N7
Smiles:
Nc1[nH+]cnc2c1C(c1nnc(-c3ccccc3)c(-c3ccccc3)n1)=C[N]2| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 365.4 | Num_heavy_atoms: | 28 |
| TPSA: | 105.82 | NumAromaticRings: | 4 |
