Glycoside
GD089442
Name:
NoneFormula:
C19H30O6N3SSmiles:
Cc1nc(C[N@@H+]2CCCC23CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC3)cs1Aglycone:
Cc1nc(C[NH+]2CCCC23CCNCC3)cs1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.74 |
| AlogP: | -2.36 | Num_rotatable_bonds: | 7 |
| MolWt: | 428.53 | Num_heavy_atoms: | 29 |
| TPSA: | 135.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD39018
Formula: C13H22N3S
Smiles:
Cc1nc(C[NH+]2CCCC23CCNCC3)cs1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.77 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 252.41 | Num_heavy_atoms: | 17 |
| TPSA: | 29.36 | NumAromaticRings: | 1 |
