Glycoside
GD013382
Name:
NoneFormula:
C12H18O9N6Smiles:
Nc1c(C(=O)NC(CN(O)N=O)C(=O)O)ncn1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
NC1=C(C(=O)NC(CN(O)N=O)C(=O)O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.58 |
| AlogP: | -3.37 | Num_rotatable_bonds: | 8 |
| MolWt: | 390.31 | Num_heavy_atoms: | 27 |
| TPSA: | 233.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD09994
Formula: C7H9O5N6
Smiles:
NC1=C(C(=O)NC(CN(O)N=O)C(=O)O)N=C[N]1| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 257.19 | Num_heavy_atoms: | 18 |
| TPSA: | 171.78 | NumAromaticRings: | 0 |
