Glycoside
GD047940
Name:
NoneFormula:
C14H16O7N2Smiles:
O=c1ocnc2ccc(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc12Aglycone:
Nc1ccc2ncoc(=O)c2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.29 | Num_heavy_atoms: | 23 |
| TPSA: | 145.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD25745
Formula: C8H6O2N2
Smiles:
Nc1ccc2ncoc(=O)c2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.15 | Num_heavy_atoms: | 12 |
| TPSA: | 69.12 | NumAromaticRings: | 2 |
