Glycoside
GD041818
Name:
NoneFormula:
C7H16O5NSSmiles:
OC[C@H](O)C(O)(O)[C@H](O)[C@@H]1[NH2+]CCS1Aglycone:
C1CSC[NH2+]1Sugarmoiety:
OCC(O)C(O)(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -3.98 | Num_rotatable_bonds: | 4 |
| MolWt: | 226.27 | Num_heavy_atoms: | 14 |
| TPSA: | 117.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD24828
Formula: C3H8NS
Smiles:
C1CSC[NH2+]1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 0 |
| MolWt: | 90.17 | Num_heavy_atoms: | 5 |
| TPSA: | 16.61 | NumAromaticRings: | 0 |
