Glycoside
GD101306
Name:
NoneFormula:
C21H29O6N3SSmiles:
Cn1nc(C(C)(C)C)cc1C(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
Cn1nc(C(C)(C)C)cc1C(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.52 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 5 |
| MolWt: | 451.55 | Num_heavy_atoms: | 31 |
| TPSA: | 137.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD42867
Formula: C15H19ON3S
Smiles:
Cn1nc(C(C)(C)C)cc1C(=O)Nc1ccc(S)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 3.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 289.4 | Num_heavy_atoms: | 20 |
| TPSA: | 46.92 | NumAromaticRings: | 2 |
