Glycoside
GD091855
Name:
NoneFormula:
C19H25O7N3SSmiles:
CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc1Aglycone:
CCN(c1ccccc1)S(=O)(=O)c1ccc(N)nc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 7 |
| MolWt: | 439.49 | Num_heavy_atoms: | 30 |
| TPSA: | 152.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD40058
Formula: C13H15O2N3S
Smiles:
CCN(c1ccccc1)S(=O)(=O)c1ccc(N)nc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 277.35 | Num_heavy_atoms: | 19 |
| TPSA: | 76.29 | NumAromaticRings: | 2 |
