Glycoside
GD091078
Name:
NoneFormula:
C15H18O5N5BrSmiles:
Cc1nc(Br)ccc1Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1nc(Br)ccc1NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 428.24 | Num_heavy_atoms: | 26 |
| TPSA: | 155.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD39692
Formula: C10H9ON5Br
Smiles:
Cc1nc(Br)ccc1NC1=C(C(N)=O)N=C[N]1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.1 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 295.12 | Num_heavy_atoms: | 17 |
| TPSA: | 94.47 | NumAromaticRings: | 1 |
