Glycoside
GD056972
Name:
NoneFormula:
C13H15O7N3Smiles:
COc1cccc(-c2noc(C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)n2)n1Aglycone:
COc1cccc(-c2ncon2)n1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 325.28 | Num_heavy_atoms: | 23 |
| TPSA: | 159.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD28622
Formula: C8H7O2N3
Smiles:
COc1cccc(-c2ncon2)n1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 2 |
| MolWt: | 177.16 | Num_heavy_atoms: | 13 |
| TPSA: | 61.04 | NumAromaticRings: | 2 |
