Glycoside
GD084772
Name:
NoneFormula:
C17H20O6N5ClSmiles:
CCOc1ncc(Cl)cc1Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOc1ncc(Cl)cc1NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 7 |
| MolWt: | 413.82 | Num_heavy_atoms: | 28 |
| TPSA: | 164.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD37913
Formula: C12H11O2N5Cl
Smiles:
CCOc1ncc(Cl)cc1NC1=C(C(N)=O)N=C[N]1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 280.69 | Num_heavy_atoms: | 19 |
| TPSA: | 103.7 | NumAromaticRings: | 1 |
