Glycoside
GD140021
Name:
lonijaposide nFormula:
C26H35O11NSmiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1C=CC1=CC=CN(CCCC(=O)O)C1Aglycone:
C=CC1C(O)OC=C(C(=O)OC)C1C=CC1=CC=CN(CCCC(=O)O)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 11 |
| MolWt: | 537.56 | Num_heavy_atoms: | 38 |
| TPSA: | 175.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD56453
Formula: C20H25O6N
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1C=CC1=CC=CN(CCCC(=O)O)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 8 |
| MolWt: | 375.42 | Num_heavy_atoms: | 27 |
| TPSA: | 96.3 | NumAromaticRings: | 0 |
