Glycoside
GD044886
Name:
NoneFormula:
C11H22O5NSSmiles:
O=C[C@H]([NH2+][C@@H]1CCCSC1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
[NH3+]C1CCCSC1Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.91 |
| AlogP: | -2.91 | Num_rotatable_bonds: | 7 |
| MolWt: | 280.37 | Num_heavy_atoms: | 18 |
| TPSA: | 114.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD25125
Formula: C5H12NS
Smiles:
[NH3+]C1CCCSC1| HBA: | 1 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 0 |
| MolWt: | 118.23 | Num_heavy_atoms: | 7 |
| TPSA: | 27.64 | NumAromaticRings: | 0 |
