Glycoside
GD051742
Name:
NoneFormula:
C14H17O6N3Smiles:
Cc1cc(-c2noc(C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)n2)cc(C)n1Aglycone:
Cc1cc(-c2ncon2)cc(C)n1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 6 |
| MolWt: | 323.31 | Num_heavy_atoms: | 23 |
| TPSA: | 149.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD27006
Formula: C9H9ON3
Smiles:
Cc1cc(-c2ncon2)cc(C)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.22 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 175.19 | Num_heavy_atoms: | 13 |
| TPSA: | 51.81 | NumAromaticRings: | 2 |
