Glycoside
GD036232
Name:
NoneFormula:
C18H25O5N3Smiles:
CC(C)(C)c1ccc(-c2n[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)n2)cc1Aglycone:
CC(C)(C)c1ccc(-c2nc[nH]n2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 3 |
| MolWt: | 363.41 | Num_heavy_atoms: | 26 |
| TPSA: | 131.72 | NumAromaticRings: | 2 |
Unique Aglycone
AD22873
Formula: C12H15N3
Smiles:
CC(C)(C)c1ccc(-c2nc[nH]n2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.77 | Num_rotatable_bonds: | 1 |
| MolWt: | 201.27 | Num_heavy_atoms: | 15 |
| TPSA: | 41.57 | NumAromaticRings: | 2 |
