Glycoside
GD098156
Name:
NoneFormula:
C21H23O6N5SSmiles:
O=C(Cc1ccc(-n2cnnn2)cc1)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc1Aglycone:
O=C(Cc1ccc(-n2cnnn2)cc1)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 7 |
| MolWt: | 473.51 | Num_heavy_atoms: | 33 |
| TPSA: | 162.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD41759
Formula: C15H13ON5S
Smiles:
O=C(Cc1ccc(-n2cnnn2)cc1)Nc1ccc(S)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 311.37 | Num_heavy_atoms: | 22 |
| TPSA: | 72.7 | NumAromaticRings: | 3 |
