Glycoside
GD098709
Name:
NoneFormula:
C21H29O9N5Smiles:
CCOC(=O)CC[C@H](NC(=O)Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(=O)OCCAglycone:
CCOC(=O)CCC(NC(=O)Nc1ncnc2c1C=C[N]2)C(=O)OCCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 10 |
| MolWt: | 495.49 | Num_heavy_atoms: | 35 |
| TPSA: | 194.36 | NumAromaticRings: | 2 |
Unique Aglycone
AD41987
Formula: C16H20O5N5
Smiles:
CCOC(=O)CCC(NC(=O)Nc1ncnc2c1C=C[N]2)C(=O)OCC| HBA: | 10 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 8 |
| MolWt: | 362.37 | Num_heavy_atoms: | 26 |
| TPSA: | 133.61 | NumAromaticRings: | 1 |
