Glycoside
GD001959
Name:
NoneFormula:
C15H16O5N3ClSmiles:
OC[C@@H]1O[C@H](n2cc(-c3cccc(Cl)c3)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1cccc(C2=C[N]N=N2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 341.75 | Num_heavy_atoms: | 23 |
| TPSA: | 120.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD01908
Formula: C9H5N3Cl
Smiles:
Clc1cccc(C2=C[N]N=N2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.6 | Num_heavy_atoms: | 12 |
| TPSA: | 38.82 | NumAromaticRings: | 1 |
