Glycoside
GD118582
Name:
lonijaposide mFormula:
C25H33O11NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1C=CC1=CC=CN(CCCC(=O)O)C1Aglycone:
C=CC1C(O)OC=C(C(=O)O)C1C=CC1=CC=CN(CCCC(=O)O)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 11 |
| MolWt: | 523.54 | Num_heavy_atoms: | 37 |
| TPSA: | 186.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD47433
Formula: C19H23O6N
Smiles:
C=CC1C(O)OC=C(C(=O)O)C1C=CC1=CC=CN(CCCC(=O)O)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.37 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 8 |
| MolWt: | 361.39 | Num_heavy_atoms: | 26 |
| TPSA: | 107.3 | NumAromaticRings: | 0 |
