Glycoside
GD079579
Name:
NoneFormula:
C19H26O7N2FSmiles:
O=C(C(=O)N1CC[N@@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Fc1cccc(OC2CC3CNCC[NH+]3C2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -3.28 | Num_rotatable_bonds: | 7 |
| MolWt: | 413.42 | Num_heavy_atoms: | 29 |
| TPSA: | 131.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD36371
Formula: C13H18ON2F
Smiles:
Fc1cccc(OC2CC3CNCC[NH+]3C2)c1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 237.3 | Num_heavy_atoms: | 17 |
| TPSA: | 25.7 | NumAromaticRings: | 1 |
