Glycoside
GD005443
Name:
NoneFormula:
C8H10O5N3ISmiles:
O=[N+]([O-])c1nccn1[C@@H]1O[C@H](CI)[C@H](O)[C@H]1OAglycone:
O=[N+]([O-])C1=NC=C[N]1Sugarmoiety:
OC1OC(CI)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 355.09 | Num_heavy_atoms: | 17 |
| TPSA: | 110.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD04625
Formula: C3H2O2N3
Smiles:
O=[N+]([O-])C1=NC=C[N]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 0 |
| MolWt: | 112.07 | Num_heavy_atoms: | 8 |
| TPSA: | 69.6 | NumAromaticRings: | 0 |
