Glycoside
GD054030
Name:
NoneFormula:
C14H18O8N2Smiles:
COC(=O)c1cc(C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)ccn1Aglycone:
COC(=O)c1cc(C(N)=O)ccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 342.3 | Num_heavy_atoms: | 24 |
| TPSA: | 158.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD27538
Formula: C8H8O3N2
Smiles:
COC(=O)c1cc(C(N)=O)ccn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 2 |
| MolWt: | 180.16 | Num_heavy_atoms: | 13 |
| TPSA: | 82.28 | NumAromaticRings: | 1 |
