Glycoside
GD057970
Name:
NoneFormula:
C12H24O7NSSmiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@H]2CCS(=O)(=O)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=S1(=O)CCC([NH2+]CCO)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -3.42 | Num_rotatable_bonds: | 5 |
| MolWt: | 326.39 | Num_heavy_atoms: | 21 |
| TPSA: | 129.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD29074
Formula: C6H14O3NS
Smiles:
O=S1(=O)CCC([NH2+]CCO)C1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 180.25 | Num_heavy_atoms: | 11 |
| TPSA: | 70.98 | NumAromaticRings: | 0 |
