Glycoside
GD069953
Name:
NoneFormula:
C17H22O4N6Smiles:
N#CC1(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCC1Aglycone:
N#CC1(CNc2ncnc3c2N=C[N]3)CCCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 374.4 | Num_heavy_atoms: | 27 |
| TPSA: | 149.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD33140
Formula: C12H13N6
Smiles:
N#CC1(CNc2ncnc3c2N=C[N]3)CCCC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 241.28 | Num_heavy_atoms: | 18 |
| TPSA: | 88.06 | NumAromaticRings: | 1 |
