Glycoside
GD057501
Name:
NoneFormula:
C13H21O7N3Smiles:
CC(C)c1nc(CC(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)no1Aglycone:
CC(C)c1nc(CC(N)=O)no1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | -2.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 331.33 | Num_heavy_atoms: | 23 |
| TPSA: | 158.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD28837
Formula: C7H11O2N3
Smiles:
CC(C)c1nc(CC(N)=O)no1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 169.18 | Num_heavy_atoms: | 12 |
| TPSA: | 82.01 | NumAromaticRings: | 1 |
