Glycoside
GD082142
Name:
NoneFormula:
C17H26O8N2SSmiles:
CC(C)N(CC(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)S(=O)(=O)c1ccccc1Aglycone:
CC(C)N(CC(N)=O)S(=O)(=O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 7 |
| MolWt: | 418.47 | Num_heavy_atoms: | 28 |
| TPSA: | 156.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD36883
Formula: C11H16O3N2S
Smiles:
CC(C)N(CC(N)=O)S(=O)(=O)c1ccccc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 256.33 | Num_heavy_atoms: | 17 |
| TPSA: | 80.47 | NumAromaticRings: | 1 |
