Glycoside
GD004303
Name:
NoneFormula:
C18H23O4N5Smiles:
Nc1nc(C#CCC2CCCC2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(C#CCC2CCCC2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 373.41 | Num_heavy_atoms: | 27 |
| TPSA: | 139.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD03779
Formula: C13H14N5
Smiles:
Nc1nc(C#CCC2CCCC2)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 240.29 | Num_heavy_atoms: | 18 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
