Glycoside
GD064428
Name:
NoneFormula:
C14H19O6N3SSmiles:
O=C([C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O)N1CCC12CN(c1nccs1)C2Aglycone:
O=CN1CCC12CN(c1nccs1)C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 2 |
| MolWt: | 357.39 | Num_heavy_atoms: | 24 |
| TPSA: | 126.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD31000
Formula: C9H11ON3S
Smiles:
O=CN1CCC12CN(c1nccs1)C2| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.56 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 209.27 | Num_heavy_atoms: | 14 |
| TPSA: | 36.44 | NumAromaticRings: | 1 |
