Glycoside
GD142500
Name:
Paratunamide DFormula:
C26H32O11N2Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)N(CCC3(O)C(O)=Nc4ccccc43)C(O)CC21Aglycone:
C=CC1C(O)OC=C2C(=O)N(CCC3(O)C(O)=Nc4ccccc43)C(O)CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.54 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 7 |
| MolWt: | 548.55 | Num_heavy_atoms: | 39 |
| TPSA: | 201.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD57339
Formula: C20H22O6N2
Smiles:
C=CC1C(O)OC=C2C(=O)N(CCC3(O)C(O)=Nc4ccccc43)C(O)CC21| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 386.4 | Num_heavy_atoms: | 28 |
| TPSA: | 122.82 | NumAromaticRings: | 1 |
