Glycoside
GD080833
Name:
NoneFormula:
C17H19O8N2ClSmiles:
CN1C(=O)COc2c(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc(Cl)cc21Aglycone:
CN1C(=O)COc2c(C(N)=O)cc(Cl)cc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 402.79 | Num_heavy_atoms: | 27 |
| TPSA: | 148.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD36492
Formula: C11H9O3N2Cl
Smiles:
CN1C(=O)COc2c(C(N)=O)cc(Cl)cc21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 1 |
| MolWt: | 240.65 | Num_heavy_atoms: | 16 |
| TPSA: | 72.63 | NumAromaticRings: | 1 |
