Glycoside
GD082128
Name:
NoneFormula:
C18H27O9NSmiles:
COc1ccc(CCC(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(OC)c1OCAglycone:
COc1ccc(CCC(N)=O)c(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 8 |
| MolWt: | 401.41 | Num_heavy_atoms: | 28 |
| TPSA: | 146.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD36877
Formula: C12H17O4N
Smiles:
COc1ccc(CCC(N)=O)c(OC)c1OC| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 239.27 | Num_heavy_atoms: | 17 |
| TPSA: | 70.78 | NumAromaticRings: | 1 |
