Glycoside
GD011844
Name:
NoneFormula:
C11H17O4N5Smiles:
OC[C@@H]1O[C@H](n2cnc(C3=NCCCN3)n2)[C@H](O)[C@H]1OAglycone:
C1=NC(C2=NCCCN2)=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -2.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 283.29 | Num_heavy_atoms: | 20 |
| TPSA: | 125.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD08991
Formula: C6H8N5
Smiles:
C1=NC(C2=NCCCN2)=N[N]1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 1 |
| MolWt: | 150.16 | Num_heavy_atoms: | 11 |
| TPSA: | 63.21 | NumAromaticRings: | 0 |
