Glycoside
GD026871
Name:
NoneFormula:
C21H24O5N4Smiles:
CCCOC(=O)Nc1ncnc2c1c(-c1ccccc1)cn2[C@@H]1O[C@H](C)[C@H](O)[C@H]1OAglycone:
CCCOC(=O)Nc1ncnc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 2.7 | Num_rotatable_bonds: | 5 |
| MolWt: | 412.45 | Num_heavy_atoms: | 30 |
| TPSA: | 118.73 | NumAromaticRings: | 3 |
Unique Aglycone
AD17692
Formula: C16H15O2N4
Smiles:
CCCOC(=O)Nc1ncnc2c1C(c1ccccc1)=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 3.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 295.32 | Num_heavy_atoms: | 22 |
| TPSA: | 78.21 | NumAromaticRings: | 2 |
