Glycoside
GD061511
Name:
NoneFormula:
C15H25O5N2SSmiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@@H]2CCc3ncsc3C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
OCC[NH2+]C1CCc2ncsc2C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.8 |
| AlogP: | -1.59 | Num_rotatable_bonds: | 5 |
| MolWt: | 345.44 | Num_heavy_atoms: | 23 |
| TPSA: | 108.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD30156
Formula: C9H15ON2S
Smiles:
OCC[NH2+]C1CCc2ncsc2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 199.3 | Num_heavy_atoms: | 13 |
| TPSA: | 49.73 | NumAromaticRings: | 1 |
