Glycoside
GD001600
Name:
NoneFormula:
C20H23O7N7Smiles:
NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12Aglycone:
NC(=O)C(Cc1ccccc1)NC(=O)C1=N[N]c2nc(N)[nH]c(=O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.35 |
| AlogP: | -2.86 | Num_rotatable_bonds: | 7 |
| MolWt: | 473.45 | Num_heavy_atoms: | 34 |
| TPSA: | 231.7 | NumAromaticRings: | 3 |
Unique Aglycone
AD01589
Formula: C15H14O3N7
Smiles:
NC(=O)C(Cc1ccccc1)NC(=O)C1=N[N]c2nc(N)[nH]c(=O)c21| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.13 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 340.32 | Num_heavy_atoms: | 25 |
| TPSA: | 170.42 | NumAromaticRings: | 2 |
