Glycoside
GD066451
Name:
NoneFormula:
C15H20O6N4Smiles:
Cc1cc(C)c2c(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)nn(C)c2n1Aglycone:
Cc1cc(C)c2c(N)nn(C)c2n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -1.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 352.35 | Num_heavy_atoms: | 25 |
| TPSA: | 157.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD31821
Formula: C9H12N4
Smiles:
Cc1cc(C)c2c(N)nn(C)c2n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.22 | Num_heavy_atoms: | 13 |
| TPSA: | 56.73 | NumAromaticRings: | 2 |
