Glycoside
GD058793
Name:
NoneFormula:
C11H19O7N3SSmiles:
CCn1cc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)cn1Aglycone:
CCn1cc(S(N)(=O)=O)cn1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -3.18 | Num_rotatable_bonds: | 9 |
| MolWt: | 337.35 | Num_heavy_atoms: | 22 |
| TPSA: | 161.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD28801
Formula: C5H9O2N3S
Smiles:
CCn1cc(S(N)(=O)=O)cn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 175.21 | Num_heavy_atoms: | 11 |
| TPSA: | 77.98 | NumAromaticRings: | 1 |
