Glycoside
GD009335
Name:
NoneFormula:
C17H21O4N5Smiles:
Nc1nc(C#CC2CCCC2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(C#CC2CCCC2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 359.39 | Num_heavy_atoms: | 26 |
| TPSA: | 139.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD07326
Formula: C12H12N5
Smiles:
Nc1nc(C#CC2CCCC2)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 0 |
| MolWt: | 226.26 | Num_heavy_atoms: | 17 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
