Glycoside
GD085037
Name:
NoneFormula:
C18H29O8N2Smiles:
COc1ccc(C[C@@H](C)[NH2+]CCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c([N+](=O)[O-])c1Aglycone:
COc1ccc(CC(C)[NH2+]CCO)c([N+](=O)[O-])c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 9 |
| MolWt: | 401.44 | Num_heavy_atoms: | 28 |
| TPSA: | 148.13 | NumAromaticRings: | 1 |
Unique Aglycone
AD38068
Formula: C12H19O4N2
Smiles:
COc1ccc(CC(C)[NH2+]CCO)c([N+](=O)[O-])c1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 7 |
| MolWt: | 255.29 | Num_heavy_atoms: | 18 |
| TPSA: | 89.21 | NumAromaticRings: | 1 |
