Glycoside
GD103299
Name:
NoneFormula:
C18H17O6N6BrSmiles:
O=C(NC(=O)c1ccccc1)Nc1ncnc2c1nc(Br)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
O=C(NC(=O)c1ccccc1)Nc1ncnc2c1N=C(Br)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.28 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 493.27 | Num_heavy_atoms: | 31 |
| TPSA: | 171.72 | NumAromaticRings: | 3 |
Unique Aglycone
AD43718
Formula: C13H8O2N6Br
Smiles:
O=C(NC(=O)c1ccccc1)Nc1ncnc2c1N=C(Br)[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 360.15 | Num_heavy_atoms: | 22 |
| TPSA: | 110.44 | NumAromaticRings: | 2 |
