Glycoside
GD066901
Name:
NoneFormula:
C14H29O7N2SSmiles:
C[C@@H]1O[C@@H](OCC[NH2+]C2CCN(S(C)(=O)=O)CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CS(=O)(=O)N1CCC([NH2+]CCO)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -3.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 369.46 | Num_heavy_atoms: | 24 |
| TPSA: | 133.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD31979
Formula: C8H19O3N2S
Smiles:
CS(=O)(=O)N1CCC([NH2+]CCO)CC1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 223.32 | Num_heavy_atoms: | 14 |
| TPSA: | 74.22 | NumAromaticRings: | 0 |
