Glycoside
GD038413
Name:
(3-nitro-5-(3-morpholin-4-yl-propylaminocarbonyl)phenyl)-galactopyranosideFormula:
C20H29O10N3Smiles:
O=C(NCCCN1CCOCC1)c1cc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc([N+](=O)[O-])c1Aglycone:
O=C(NCCCN1CCOCC1)c1cc(O)cc([N+](=O)[O-])c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 9 |
| MolWt: | 471.46 | Num_heavy_atoms: | 33 |
| TPSA: | 184.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD24013
Formula: C14H19O5N3
Smiles:
O=C(NCCCN1CCOCC1)c1cc(O)cc([N+](=O)[O-])c1| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 309.32 | Num_heavy_atoms: | 22 |
| TPSA: | 104.94 | NumAromaticRings: | 1 |
