Glycoside
GD076289
Name:
NoneFormula:
C15H24O7N2SSmiles:
O=C([C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)N1C[C@@H]2CCN(C(=O)CCS)[C@@H]2C1Aglycone:
O=CN1CC2CCN(C(=O)CCS)C2C1Sugarmoiety:
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
AD35203
Formula: C10H16O2N2S
Smiles:
O=CN1CC2CCN(C(=O)CCS)C2C1| 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 |
