Glycoside
GD074471
Name:
NoneFormula:
C15H26O8N2SSmiles:
CS(=O)(=O)CCN1CC2(CCN(C(=O)[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@H]3O)C2)C1Aglycone:
CS(=O)(=O)CCN1CC2(CCN(C=O)C2)C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | -3.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 394.45 | Num_heavy_atoms: | 26 |
| TPSA: | 147.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD34423
Formula: C10H18O3N2S
Smiles:
CS(=O)(=O)CCN1CC2(CCN(C=O)C2)C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.9 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 246.33 | Num_heavy_atoms: | 16 |
| TPSA: | 57.69 | NumAromaticRings: | 0 |
