Glycoside
GD028596
Name:
NoneFormula:
C14H16O5N6Smiles:
C[C@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1cc(-c2nnco2)c2c(N)ncnc21Aglycone:
Nc1ncnc2c1C(c1nnco1)=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.32 | Num_heavy_atoms: | 25 |
| TPSA: | 165.57 | NumAromaticRings: | 3 |
Unique Aglycone
AD06414
Formula: C8H5ON6
Smiles:
Nc1ncnc2c1C(c1nnco1)=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 201.17 | Num_heavy_atoms: | 15 |
| TPSA: | 104.82 | NumAromaticRings: | 2 |
