Glycoside
GD122881
Name:
NoneFormula:
C16H25O4N4Smiles:
[NH3+]CC1OC(CC(=[O+])N2CCN(c3ccccn3)CC2)C(O)C1OAglycone:
CC(=[OH+])N1CCN(c2ccccn2)CC1Sugarmoiety:
[NH3+]CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 4 |
| MolWt: | 337.4 | Num_heavy_atoms: | 24 |
| TPSA: | 116.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD47809
Formula: C11H16ON3
Smiles:
CC(=[OH+])N1CCN(c2ccccn2)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 0.73 | Num_rotatable_bonds: | 1 |
| MolWt: | 206.27 | Num_heavy_atoms: | 15 |
| TPSA: | 40.77 | NumAromaticRings: | 1 |
