Glycoside
GD092823
Name:
NoneFormula:
C23H31O7N2Smiles:
C[C@@](OCC[N+](C)(C)[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)(c1ccccc1)c1ccccn1Aglycone:
C[NH+](C)CCOC(C)(c1ccccc1)c1ccccn1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 8 |
| MolWt: | 447.51 | Num_heavy_atoms: | 32 |
| TPSA: | 129.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD40363
Formula: C17H23ON2
Smiles:
C[NH+](C)CCOC(C)(c1ccccc1)c1ccccn1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 271.38 | Num_heavy_atoms: | 20 |
| TPSA: | 26.56 | NumAromaticRings: | 2 |