Glycoside
GD076271
Name:
NoneFormula:
C15H24O7N2SSmiles:
O=C(CCS)N1CC2(CCN(C(=O)[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)C2)C1Aglycone:
O=CN1CCC2(C1)CN(C(=O)CCS)C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | -2.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 376.43 | Num_heavy_atoms: | 25 |
| TPSA: | 130.77 | NumAromaticRings: | 0 |
Unique Aglycone
AD35200
Formula: C10H16O2N2S
Smiles:
O=CN1CCC2(C1)CN(C(=O)CCS)C2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.8 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 3 |
| MolWt: | 228.32 | Num_heavy_atoms: | 15 |
| TPSA: | 40.62 | NumAromaticRings: | 0 |
