Glycoside
GD102618
Name:
NoneFormula:
C19H30O9N2SSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)Nc1ccc(S(=O)(=O)NCCO)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 7 |
| MolWt: | 462.52 | Num_heavy_atoms: | 31 |
| TPSA: | 163.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD43444
Formula: C13H20O5N2S
Smiles:
CC(C)(C)OC(=O)Nc1ccc(S(=O)(=O)NCCO)cc1| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 316.38 | Num_heavy_atoms: | 21 |
| TPSA: | 104.73 | NumAromaticRings: | 1 |
