Glycoside
GD013489
Name:
NoneFormula:
C22H25O5N7Smiles:
CCNc1nc(-n2cc(-c3ccc(OC)cc3)cn2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCNc1nc(-n2cc(-c3ccc(OC)cc3)cn2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | 0.73 | Num_rotatable_bonds: | 7 |
| MolWt: | 467.49 | Num_heavy_atoms: | 34 |
| TPSA: | 152.6 | NumAromaticRings: | 4 |
Unique Aglycone
AD10054
Formula: C17H16ON7
Smiles:
CCNc1nc(-n2cc(-c3ccc(OC)cc3)cn2)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 2.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 334.36 | Num_heavy_atoms: | 25 |
| TPSA: | 91.32 | NumAromaticRings: | 3 |
