Glycoside
GD048018
Name:
NoneFormula:
C14H18O5N4Smiles:
Cc1cnc2ncc(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc2n1Aglycone:
Cc1cnc2ncc(N)cc2n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 322.32 | Num_heavy_atoms: | 23 |
| TPSA: | 140.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD25779
Formula: C8H8N4
Smiles:
Cc1cnc2ncc(N)cc2n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 0 |
| MolWt: | 160.18 | Num_heavy_atoms: | 12 |
| TPSA: | 64.69 | NumAromaticRings: | 2 |
