Glycoside
GD134827
Name:
Lonijaposide BFormula:
C25H33O12NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=CN(CCO)C1Aglycone:
C=CC1C(O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=CN(CCO)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 10 |
| MolWt: | 539.53 | Num_heavy_atoms: | 38 |
| TPSA: | 195.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD47159
Formula: C19H23O7N
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1C=CC1=CC(C(=O)O)=CN(CCO)C1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.37 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 7 |
| MolWt: | 377.39 | Num_heavy_atoms: | 27 |
| TPSA: | 116.53 | NumAromaticRings: | 0 |
