Glycoside
GD075472
Name:
NoneFormula:
C15H19O7N3SSmiles:
COC(=O)c1sc2[nH]cn/c(=N\[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2c1CAglycone:
COC(=O)c1sc2[nH]cnc(=N)c2c1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 385.4 | Num_heavy_atoms: | 26 |
| TPSA: | 157.49 | NumAromaticRings: | 2 |
Unique Aglycone
AD34968
Formula: C9H9O2N3S
Smiles:
COC(=O)c1sc2[nH]cnc(=N)c2c1C| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 1 |
| MolWt: | 223.26 | Num_heavy_atoms: | 15 |
| TPSA: | 78.83 | NumAromaticRings: | 2 |
