Glycoside
GD031357
Name:
NoneFormula:
C21H24O7N2Smiles:
CC(=O)N[C@@H]1[C@H](Oc2ccccc2-c2cccc(C(N)=O)c2)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
NC(=O)c1cccc(-c2ccccc2O)c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 6 |
| MolWt: | 416.43 | Num_heavy_atoms: | 30 |
| TPSA: | 151.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD20211
Formula: C13H11O2N
Smiles:
NC(=O)c1cccc(-c2ccccc2O)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 213.24 | Num_heavy_atoms: | 16 |
| TPSA: | 63.32 | NumAromaticRings: | 2 |
