Glycoside
GD095346
Name:
NoneFormula:
C19H29O8N3SSmiles:
CN1CCN(c2cc(S(C)(=O)=O)ccc2C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1Aglycone:
CN1CCN(c2cc(S(C)(=O)=O)ccc2C(N)=O)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -2.63 | Num_rotatable_bonds: | 5 |
| MolWt: | 459.52 | Num_heavy_atoms: | 31 |
| TPSA: | 159.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD40693
Formula: C13H19O3N3S
Smiles:
CN1CCN(c2cc(S(C)(=O)=O)ccc2C(N)=O)CC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 297.38 | Num_heavy_atoms: | 20 |
| TPSA: | 83.71 | NumAromaticRings: | 1 |
