Glycoside
GD091103
Name:
NoneFormula:
C18H24O7NBrSmiles:
Cc1cc(C(=O)CCC(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(C)cc1BrAglycone:
Cc1cc(C(=O)CCC(N)=O)c(C)cc1BrSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 6 |
| MolWt: | 446.29 | Num_heavy_atoms: | 27 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD39705
Formula: C12H14O2NBr
Smiles:
Cc1cc(C(=O)CCC(N)=O)c(C)cc1Br| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 284.15 | Num_heavy_atoms: | 16 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
