Glycoside
GD011429
Name:
NoneFormula:
C13H19O6N2ISmiles:
CCCCOC(=O)c1nn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1IAglycone:
CCCCOC(=O)C1=N[N]C=C1ISugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.69 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 6 |
| MolWt: | 426.21 | Num_heavy_atoms: | 22 |
| TPSA: | 114.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD08739
Formula: C8H10O2N2I
Smiles:
CCCCOC(=O)C1=N[N]C=C1I| HBA: | 4 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 4 |
| MolWt: | 293.08 | Num_heavy_atoms: | 13 |
| TPSA: | 52.76 | NumAromaticRings: | 0 |
