Glycoside
GD012776
Name:
NoneFormula:
C14H16O6N2Smiles:
O=C1N=CC(O)c2ccccc2N1C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=C1N=CC(O)c2ccccc2N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 308.29 | Num_heavy_atoms: | 22 |
| TPSA: | 122.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD09598
Formula: C9H8O2N2
Smiles:
O=C1N=CC(O)c2ccccc2N1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.17 | Num_heavy_atoms: | 13 |
| TPSA: | 61.69 | NumAromaticRings: | 1 |
