Glycoside
GD018239
Name:
NoneFormula:
C16H20O5N4Smiles:
Cc1ccc(C=C2NC(=NN=CC(O)C(O)C(O)CO)NC2=O)cc1Aglycone:
C=NN=C1NC(=O)C(=Cc2ccc(C)cc2)N1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.31 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 348.36 | Num_heavy_atoms: | 25 |
| TPSA: | 146.77 | NumAromaticRings: | 1 |
Unique Aglycone
AD02807
Formula: C12H12ON4
Smiles:
C=NN=C1NC(=O)C(=Cc2ccc(C)cc2)N1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 2 |
| MolWt: | 228.25 | Num_heavy_atoms: | 17 |
| TPSA: | 65.85 | NumAromaticRings: | 1 |
