Glycoside
GD093866
Name:
NoneFormula:
C19H29O7N4SSmiles:
CCOC(=O)c1sc2[nH]c(C[NH+](C)C)n/c(=N\[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2c1CAglycone:
CCOC(=O)c1sc2[nH]c(C[NH+](C)C)nc(=N)c2c1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.63 |
| AlogP: | -2.55 | Num_rotatable_bonds: | 6 |
| MolWt: | 457.53 | Num_heavy_atoms: | 31 |
| TPSA: | 161.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD40467
Formula: C13H19O2N4S
Smiles:
CCOC(=O)c1sc2[nH]c(C[NH+](C)C)nc(=N)c2c1C| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 295.39 | Num_heavy_atoms: | 20 |
| TPSA: | 83.27 | NumAromaticRings: | 2 |
