Glycoside
GD017735
Name:
NoneFormula:
C15H19O7N3S2Smiles:
CCOC(=O)c1sc2nc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)n(N)c(=O)c2c1CAglycone:
CCOC(=O)c1sc2nc(S)n(N)c(=O)c2c1CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -0.81 | Num_rotatable_bonds: | 5 |
| MolWt: | 417.47 | Num_heavy_atoms: | 27 |
| TPSA: | 157.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD04278
Formula: C10H11O3N3S2
Smiles:
CCOC(=O)c1sc2nc(S)n(N)c(=O)c2c1C| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 285.35 | Num_heavy_atoms: | 18 |
| TPSA: | 87.21 | NumAromaticRings: | 2 |
