Glycoside
GD053379
Name:
NoneFormula:
C15H31O5N4Smiles:
CC(C)NC(=O)NC[C@H]1O[C@@H](CC(=O)NCC[NH+](C)C)[C@H](O)[C@@H]1OAglycone:
CC(=O)NCC[NH+](C)C.CNC(=O)NC(C)CSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.87 |
| AlogP: | -3.17 | Num_rotatable_bonds: | 8 |
| MolWt: | 347.44 | Num_heavy_atoms: | 24 |
| TPSA: | 124.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD21840
Formula: C5H12ON2
Smiles:
CNC(=O)NC(C)C| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 116.16 | Num_heavy_atoms: | 8 |
| TPSA: | 41.13 | NumAromaticRings: | 0 |
AD27256
Formula: C6H15ON2
Smiles:
CC(=O)NCC[NH+](C)C| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.83 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 3 |
| MolWt: | 131.2 | Num_heavy_atoms: | 9 |
| TPSA: | 33.54 | NumAromaticRings: | 0 |
