Glycoside
GD032900
Name:
NoneFormula:
C19H19O6N3SSmiles:
O=C(Nc1cccc2cccnc12)c1csc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)n1Aglycone:
O=C(Nc1cccc2cccnc12)c1cscn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 417.44 | Num_heavy_atoms: | 29 |
| TPSA: | 145.03 | NumAromaticRings: | 3 |
Unique Aglycone
AD21045
Formula: C13H9ON3S
Smiles:
O=C(Nc1cccc2cccnc12)c1cscn1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 255.3 | Num_heavy_atoms: | 18 |
| TPSA: | 54.88 | NumAromaticRings: | 3 |
