Glycoside
GD036455
Name:
NoneFormula:
C16H20O5N3ClSmiles:
CCCCOc1ncnc2c1c(Cl)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCCCOc1ncnc2c1C(Cl)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 6 |
| MolWt: | 357.79 | Num_heavy_atoms: | 24 |
| TPSA: | 109.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD22986
Formula: C11H11ON3Cl
Smiles:
CCCCOc1ncnc2c1C(Cl)=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 224.67 | Num_heavy_atoms: | 15 |
| TPSA: | 49.11 | NumAromaticRings: | 1 |
