Glycoside
GD027934
Name:
NoneFormula:
C13H19O4N5Smiles:
CO[C@@]1(c2ccc3c(N)ncnn23)O[C@H](CO)[C@H](O)[C@]1(C)NAglycone:
Nc1ncnn2cccc12Sugarmoiety:
COC1(O)OC(CO)C(O)C1(C)NOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 3 |
| MolWt: | 309.33 | Num_heavy_atoms: | 22 |
| TPSA: | 141.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD05072
Formula: C6H6N4
Smiles:
Nc1ncnn2cccc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.14 | Num_heavy_atoms: | 10 |
| TPSA: | 56.21 | NumAromaticRings: | 2 |
