Glycoside
GD048101
Name:
NoneFormula:
C12H16O6N2SSmiles:
O=C(Nc1nc(C2CC2)cs1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Nc1nc(C2CC2)cs1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 316.34 | Num_heavy_atoms: | 21 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD25812
Formula: C6H8N2S
Smiles:
Nc1nc(C2CC2)cs1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 1 |
| MolWt: | 140.21 | Num_heavy_atoms: | 9 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
