Glycoside
GD083840
Name:
NoneFormula:
C20H28O8N2Smiles:
O=C(OC1CCC1)c1ccc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc1OC1CCC1Aglycone:
Nc1ccc(C(=O)OC2CCC2)c(OC2CCC2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 424.45 | Num_heavy_atoms: | 30 |
| TPSA: | 150.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD37372
Formula: C14H18O3N2
Smiles:
Nc1ccc(C(=O)OC2CCC2)c(OC2CCC2)n1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 262.31 | Num_heavy_atoms: | 19 |
| TPSA: | 74.44 | NumAromaticRings: | 1 |
