Glycoside
GD095499
Name:
NoneFormula:
C19H29O9N3SSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccc(NC(=O)N3CCOCC3)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(Nc1ccc(S(=O)(=O)NCCO)cc1)N1CCOCC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -1.33 | Num_rotatable_bonds: | 7 |
| MolWt: | 475.52 | Num_heavy_atoms: | 32 |
| TPSA: | 166.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD40745
Formula: C13H19O5N3S
Smiles:
O=C(Nc1ccc(S(=O)(=O)NCCO)cc1)N1CCOCC1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 5 |
| MolWt: | 329.38 | Num_heavy_atoms: | 22 |
| TPSA: | 107.97 | NumAromaticRings: | 1 |
