Glycoside
GD098904
Name:
NoneFormula:
C19H31O9N3SSmiles:
CCOc1ccc(NC(=O)N(C)C)cc1S(=O)(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CCOc1ccc(NC(=O)N(C)C)cc1S(=O)(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 9 |
| MolWt: | 477.54 | Num_heavy_atoms: | 32 |
| TPSA: | 166.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD42078
Formula: C13H21O5N3S
Smiles:
CCOc1ccc(NC(=O)N(C)C)cc1S(=O)(=O)NCCO| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 7 |
| MolWt: | 331.39 | Num_heavy_atoms: | 22 |
| TPSA: | 107.97 | NumAromaticRings: | 1 |
