Glycoside
GD055256
Name:
NoneFormula:
C14H17O7N3Smiles:
Cc1cc2n(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)c(C)cc(=O)n2n1Aglycone:
CC1=CC(=O)n2nc(C)cc2[N]1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -2.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 339.3 | Num_heavy_atoms: | 24 |
| TPSA: | 154.36 | NumAromaticRings: | 2 |
Unique Aglycone
AD28011
Formula: C8H8ON3
Smiles:
CC1=CC(=O)n2nc(C)cc2[N]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.17 | Num_heavy_atoms: | 12 |
| TPSA: | 48.99 | NumAromaticRings: | 1 |
