Glycoside
GD004116
Name:
NoneFormula:
C13H17O7N7Smiles:
NC(=O)CNC(=O)c1nn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12Aglycone:
NC(=O)CNC(=O)C1=N[N]c2nc(N)[nH]c(=O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.46 |
| AlogP: | -4.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 383.32 | Num_heavy_atoms: | 27 |
| TPSA: | 231.7 | NumAromaticRings: | 2 |
Unique Aglycone
AD03645
Formula: C8H8O3N7
Smiles:
NC(=O)CNC(=O)C1=N[N]c2nc(N)[nH]c(=O)c21| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.12 |
| AlogP: | -3.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 250.2 | Num_heavy_atoms: | 18 |
| TPSA: | 170.42 | NumAromaticRings: | 1 |
