Glycoside
GD062887
Name:
NoneFormula:
C13H19O6N5SSmiles:
CSc1nc2c(nc(N)n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(=O)n1CAglycone:
CSc1nc2c(c(=O)n1C)N=C(N)[N]2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | -2.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 373.39 | Num_heavy_atoms: | 25 |
| TPSA: | 168.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD06685
Formula: C7H8ON5S
Smiles:
CSc1nc2c(c(=O)n1C)N=C(N)[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 210.24 | Num_heavy_atoms: | 14 |
| TPSA: | 87.37 | NumAromaticRings: | 1 |
