Glycoside
GD003428
Name:
NoneFormula:
C19H23O5N5Smiles:
COc1cccc(CCNc2ncnc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)c1Aglycone:
COc1cccc(CCNc2ncnc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 7 |
| MolWt: | 401.42 | Num_heavy_atoms: | 29 |
| TPSA: | 134.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD03120
Formula: C14H14ON5
Smiles:
COc1cccc(CCNc2ncnc3c2N=C[N]3)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 268.3 | Num_heavy_atoms: | 20 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |
