Glycoside
GD034411
Name:
NoneFormula:
C24H27O6N3Smiles:
CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OCc2cc(-c3cccc(-c4ccccc4)c3)nc(N)n2)[C@H]1OAglycone:
Nc1nc(CO)cc(-c2cccc(-c3ccccc3)c2)n1Sugarmoiety:
COC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 7 |
| MolWt: | 453.5 | Num_heavy_atoms: | 33 |
| TPSA: | 140.18 | NumAromaticRings: | 3 |
Unique Aglycone
AD21884
Formula: C17H15ON3
Smiles:
Nc1nc(CO)cc(-c2cccc(-c3ccccc3)c2)n1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 277.33 | Num_heavy_atoms: | 21 |
| TPSA: | 72.03 | NumAromaticRings: | 3 |
