Glycoside
GD057218
Name:
NoneFormula:
C13H14O5N5ClSmiles:
OC[C@H]1O[C@@H](n2cc(-c3ncc(Cl)cn3)nn2)[C@H](O)[C@@H](O)[C@H]1OAglycone:
Clc1cnc(C2=C[N]N=N2)nc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 343.73 | Num_heavy_atoms: | 23 |
| TPSA: | 146.64 | NumAromaticRings: | 2 |
Unique Aglycone
AD28729
Formula: C7H3N5Cl
Smiles:
Clc1cnc(C2=C[N]N=N2)nc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.58 | Num_heavy_atoms: | 12 |
| TPSA: | 64.6 | NumAromaticRings: | 1 |
