Glycoside
GD048656
Name:
NoneFormula:
C12H16O6N3FSmiles:
C[C@@H](NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)c1ncc(F)cn1Aglycone:
CC(N)c1ncc(F)cn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.56 | Num_rotatable_bonds: | 7 |
| MolWt: | 317.27 | Num_heavy_atoms: | 22 |
| TPSA: | 152.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD25929
Formula: C6H8N3F
Smiles:
CC(N)c1ncc(F)cn1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 141.15 | Num_heavy_atoms: | 10 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
