Glycoside
GD028831
Name:
NoneFormula:
C17H18O6N3ClSSmiles:
O=C(NCc1ccc(Cl)nc1)c1csc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)n1Aglycone:
O=C(NCc1ccc(Cl)nc1)c1cscn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 415.86 | Num_heavy_atoms: | 27 |
| TPSA: | 145.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD18794
Formula: C11H8ON3ClS
Smiles:
O=C(NCc1ccc(Cl)nc1)c1cscn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 253.71 | Num_heavy_atoms: | 16 |
| TPSA: | 54.88 | NumAromaticRings: | 2 |
