Glycoside
GD050195
Name:
NoneFormula:
C9H19O8N2SSmiles:
CS(=O)(=O)N(CC[NH3+])C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
CS(=O)(=O)NCC[NH3+]Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 0 |
| HBD: | 7 | FractionCSP3: | 0.78 |
| AlogP: | -5.34 | Num_rotatable_bonds: | 8 |
| MolWt: | 315.32 | Num_heavy_atoms: | 20 |
| TPSA: | 180.08 | NumAromaticRings: | 0 |
Unique Aglycone
AD26547
Formula: C3H11O2N2S
Smiles:
CS(=O)(=O)NCC[NH3+]| HBA: | 4 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -2.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 139.2 | Num_heavy_atoms: | 8 |
| TPSA: | 73.81 | NumAromaticRings: | 0 |
