Glycoside
GD057794
Name:
NoneFormula:
C13H19O6N4Smiles:
O=C(C(=O)N(c1ncccn1)C1C[NH2+]C1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1cnc(NC2C[NH2+]C2)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -4.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 327.32 | Num_heavy_atoms: | 23 |
| TPSA: | 160.69 | NumAromaticRings: | 1 |
Unique Aglycone
AD29007
Formula: C7H11N4
Smiles:
c1cnc(NC2C[NH2+]C2)nc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 151.19 | Num_heavy_atoms: | 11 |
| TPSA: | 54.42 | NumAromaticRings: | 1 |
