Glycoside
GD073467
Name:
NoneFormula:
C17H23O6N5Smiles:
O=C(C(=O)N1CCCn2cnc(Cn3cccn3)c2C1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
c1cnn(Cc2ncn3c2CNCCC3)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -2.5 | Num_rotatable_bonds: | 7 |
| MolWt: | 393.4 | Num_heavy_atoms: | 28 |
| TPSA: | 153.94 | NumAromaticRings: | 2 |
Unique Aglycone
AD34054
Formula: C11H15N5
Smiles:
c1cnn(Cc2ncn3c2CNCCC3)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 217.28 | Num_heavy_atoms: | 16 |
| TPSA: | 47.67 | NumAromaticRings: | 2 |
