Glycoside
GD151029
Name:
lonijaposide lFormula:
C24H31O11NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1C=CC1=CC=CN(CCC(=O)O)C1Aglycone:
C=CC1C(O)OC=C(C(=O)O)C1C=CC1=CC=CN(CCC(=O)O)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 10 |
| MolWt: | 509.51 | Num_heavy_atoms: | 36 |
| TPSA: | 186.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD60275
Formula: C18H21O6N
Smiles:
C=CC1C(O)OC=C(C(=O)O)C1C=CC1=CC=CN(CCC(=O)O)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 7 |
| MolWt: | 347.37 | Num_heavy_atoms: | 25 |
| TPSA: | 107.3 | NumAromaticRings: | 0 |
