Glycoside
GD153346
Name:
Paratunamide AFormula:
C27H34O11N2Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C2C(=O)N(CCC3(O)C(O)=Nc4ccccc43)C(OC)CC21Aglycone:
C=CC1C(O)OC=C2C(=O)N(CCC3(O)C(O)=Nc4ccccc43)C(OC)CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 8 |
| MolWt: | 562.57 | Num_heavy_atoms: | 40 |
| TPSA: | 190.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD60993
Formula: C21H24O6N2
Smiles:
C=CC1C(O)OC=C2C(=O)N(CCC3(O)C(O)=Nc4ccccc43)C(OC)CC21| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 5 |
| MolWt: | 400.43 | Num_heavy_atoms: | 29 |
| TPSA: | 111.82 | NumAromaticRings: | 1 |
