Glycoside
GD002917
Name:
NoneFormula:
C15H22O4N5Smiles:
CC(C)=CC[n+]1cnc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1NAglycone:
CC(C)=CC[n+]1cnc2c(c1N)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 336.37 | Num_heavy_atoms: | 24 |
| TPSA: | 130.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD02719
Formula: C10H13N5
Smiles:
CC(C)=CC[n+]1cnc2c(c1N)N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 203.25 | Num_heavy_atoms: | 15 |
| TPSA: | 69.25 | NumAromaticRings: | 1 |
