Glycoside
GD028658
Name:
NoneFormula:
C18H23O8NSmiles:
CC(=O)Oc1ccc(C=CC(=O)NC[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
CNC(=O)C=Cc1ccc(OC(C)=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 381.38 | Num_heavy_atoms: | 27 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD18701
Formula: C12H13O3N
Smiles:
CNC(=O)C=Cc1ccc(OC(C)=O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 219.24 | Num_heavy_atoms: | 16 |
| TPSA: | 55.4 | NumAromaticRings: | 1 |
