Glycoside
GD075002
Name:
NoneFormula:
C18H25O8NSmiles:
CC1(COc2ccc(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc2)COC1Aglycone:
CC1(COc2ccc(C(N)=O)cc2)COC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 6 |
| MolWt: | 383.4 | Num_heavy_atoms: | 27 |
| TPSA: | 137.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD34702
Formula: C12H15O3N
Smiles:
CC1(COc2ccc(C(N)=O)cc2)COC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 221.26 | Num_heavy_atoms: | 16 |
| TPSA: | 61.55 | NumAromaticRings: | 1 |
