Glycoside
GD010612
Name:
NoneFormula:
C12H17O5N7Smiles:
NNc1c(C(N)=O)c2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
NNC1=C(C(N)=O)c2c(N)ncnc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.42 |
| AlogP: | -2.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 339.31 | Num_heavy_atoms: | 24 |
| TPSA: | 207.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD00785
Formula: C7H8ON7
Smiles:
NNC1=C(C(N)=O)c2c(N)ncnc2[N]1| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.0 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 206.19 | Num_heavy_atoms: | 15 |
| TPSA: | 147.04 | NumAromaticRings: | 1 |
