Glycoside
GD052719
Name:
NoneFormula:
C11H16O7N4SSmiles:
COC(=O)CNc1nn([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=S)[nH]c1=OAglycone:
COC(=O)CNc1n[nH]c(=S)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -2.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.34 | Num_heavy_atoms: | 23 |
| TPSA: | 158.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD27199
Formula: C6H8O3N4S
Smiles:
COC(=O)CNc1n[nH]c(=S)[nH]c1=O| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 216.22 | Num_heavy_atoms: | 14 |
| TPSA: | 99.87 | NumAromaticRings: | 1 |
