Glycoside
GD061452
Name:
NoneFormula:
C16H28O5N3Smiles:
CC[NH+](CC)Cc1cncc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CC[NH+](CC)Cc1cncc(N)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -2.28 | Num_rotatable_bonds: | 7 |
| MolWt: | 342.42 | Num_heavy_atoms: | 24 |
| TPSA: | 119.51 | NumAromaticRings: | 1 |
Unique Aglycone
AD30140
Formula: C10H18N3
Smiles:
CC[NH+](CC)Cc1cncc(N)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 180.28 | Num_heavy_atoms: | 13 |
| TPSA: | 43.35 | NumAromaticRings: | 1 |
