Glycoside
GD099903
Name:
NoneFormula:
C19H19O9N4ClSmiles:
COC(=O)[C@@H]1O[C@H](n2cnc3c(Cl)ncnc32)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
Clc1ncnc2c1N=C[N]2Sugarmoiety:
COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 470.82 | Num_heavy_atoms: | 32 |
| TPSA: | 158.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD05203
Formula: C6H2N4Cl
Smiles:
Clc1ncnc2c1N=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.04 | Num_rotatable_bonds: | 0 |
| MolWt: | 153.55 | Num_heavy_atoms: | 10 |
| TPSA: | 52.24 | NumAromaticRings: | 1 |
