Glycoside
GD055094
Name:
NoneFormula:
C14H22O6N4Smiles:
Cn1cnnc1C1CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC1Aglycone:
Cn1cnnc1C1CCNCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -2.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 342.35 | Num_heavy_atoms: | 24 |
| TPSA: | 149.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD27972
Formula: C8H14N4
Smiles:
Cn1cnnc1C1CCNCC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 166.23 | Num_heavy_atoms: | 12 |
| TPSA: | 42.74 | NumAromaticRings: | 1 |
