Glycoside
GD055259
Name:
NoneFormula:
C15H18O7N2Smiles:
CN1Cc2cccc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)c2C1=OAglycone:
CN1Cc2cccc(N)c2C1=OSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 6 |
| MolWt: | 338.32 | Num_heavy_atoms: | 24 |
| TPSA: | 147.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD28009
Formula: C9H10ON2
Smiles:
CN1Cc2cccc(N)c2C1=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.19 | Num_heavy_atoms: | 12 |
| TPSA: | 46.33 | NumAromaticRings: | 1 |
