Glycoside
GD051807
Name:
NoneFormula:
C14H16O7N2Smiles:
COc1cccc(-c2nnc(C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)o2)c1Aglycone:
COc1cccc(-c2nnco2)c1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | -1.0 | Num_rotatable_bonds: | 7 |
| MolWt: | 324.29 | Num_heavy_atoms: | 23 |
| TPSA: | 146.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD27019
Formula: C9H8O2N2
Smiles:
COc1cccc(-c2nnco2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 176.17 | Num_heavy_atoms: | 13 |
| TPSA: | 48.15 | NumAromaticRings: | 2 |
