Glycoside
GD021975
Name:
NoneFormula:
C18H20O4N4Smiles:
Cc1nc(N)c2c(-c3ccccc3)cn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
Cc1nc(N)c2c(n1)[N]C=C2c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 356.38 | Num_heavy_atoms: | 26 |
| TPSA: | 126.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD14953
Formula: C13H11N4
Smiles:
Cc1nc(N)c2c(n1)[N]C=C2c1ccccc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 223.26 | Num_heavy_atoms: | 17 |
| TPSA: | 65.9 | NumAromaticRings: | 2 |
