Glycoside
GD004949
Name:
NoneFormula:
C25H30O9N2Smiles:
COc1cc(C=CC(=O)N(CC(=O)N[C@H]2[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O)Cc2ccccc2)ccc1OAglycone:
COc1cc(C=CC(=O)N(CC(N)=O)Cc2ccccc2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 9 |
| MolWt: | 502.52 | Num_heavy_atoms: | 36 |
| TPSA: | 169.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD04257
Formula: C19H20O4N2
Smiles:
COc1cc(C=CC(=O)N(CC(N)=O)Cc2ccccc2)ccc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.16 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 340.38 | Num_heavy_atoms: | 25 |
| TPSA: | 92.86 | NumAromaticRings: | 2 |
