Glycoside
GD019622
Name:
NoneFormula:
C11H12O5N2SSmiles:
O=c1[nH]cnc2c([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)scc12Aglycone:
O=c1[nH]cnc2cscc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 2 |
| MolWt: | 284.29 | Num_heavy_atoms: | 19 |
| TPSA: | 115.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD13673
Formula: C6H4ON2S
Smiles:
O=c1[nH]cnc2cscc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 0 |
| MolWt: | 152.18 | Num_heavy_atoms: | 10 |
| TPSA: | 45.75 | NumAromaticRings: | 2 |
