Glycoside
GD079599
Name:
NoneFormula:
C19H27O6N3ClSmiles:
C[NH+]1CCN(c2ccc(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc2Cl)CC1Aglycone:
C[NH+]1CCN(c2ccc(C(N)=O)cc2Cl)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | -2.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 416.88 | Num_heavy_atoms: | 28 |
| TPSA: | 126.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD36378
Formula: C13H17ON3Cl
Smiles:
C[NH+]1CCN(c2ccc(C(N)=O)cc2Cl)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 2 |
| MolWt: | 254.74 | Num_heavy_atoms: | 17 |
| TPSA: | 50.77 | NumAromaticRings: | 1 |
