Glycoside
GD080888
Name:
NoneFormula:
C17H24O9N2Smiles:
CCOC(=O)c1ccnc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1C(=O)OCCAglycone:
CCOC(=O)c1ccnc(N)c1C(=O)OCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 7 |
| MolWt: | 400.38 | Num_heavy_atoms: | 28 |
| TPSA: | 167.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD36518
Formula: C11H14O4N2
Smiles:
CCOC(=O)c1ccnc(N)c1C(=O)OCC| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 238.24 | Num_heavy_atoms: | 17 |
| TPSA: | 91.51 | NumAromaticRings: | 1 |
