Glycoside
GD066125
Name:
NoneFormula:
C13H18O8N2SSmiles:
CS(=O)(=O)N(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)c1cccc(N)c1Aglycone:
CS(=O)(=O)Nc1cccc(N)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | -2.79 | Num_rotatable_bonds: | 7 |
| MolWt: | 362.36 | Num_heavy_atoms: | 24 |
| TPSA: | 178.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD31738
Formula: C7H10O2N2S
Smiles:
CS(=O)(=O)Nc1cccc(N)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.24 | Num_heavy_atoms: | 12 |
| TPSA: | 72.19 | NumAromaticRings: | 1 |
