Glycoside
GD061164
Name:
NoneFormula:
C14H18O5N3ClSmiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cc(Cl)nc(C3CC3)n2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(Cl)nc(C2CC2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 331.76 | Num_heavy_atoms: | 22 |
| TPSA: | 127.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD30034
Formula: C8H8N3Cl
Smiles:
Nc1cc(Cl)nc(C2CC2)n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 1 |
| MolWt: | 169.61 | Num_heavy_atoms: | 11 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
