Glycoside
GD091174
Name:
NoneFormula:
C10H12O6N2SBr2Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1sc(Br)nc1BrAglycone:
NC(=O)c1sc(Br)nc1BrSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 448.09 | Num_heavy_atoms: | 21 |
| TPSA: | 132.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD39743
Formula: C4H2ON2SBr2
Smiles:
NC(=O)c1sc(Br)nc1Br| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 1 |
| MolWt: | 285.95 | Num_heavy_atoms: | 10 |
| TPSA: | 55.98 | NumAromaticRings: | 1 |
