Glycoside
GD036009
Name:
NoneFormula:
C19H25O8N3Smiles:
COC(=O)CCCOc1cccc(-c2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)c1Aglycone:
COC(=O)CCCOc1cccc(C2=C[N]N=N2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 8 |
| MolWt: | 423.42 | Num_heavy_atoms: | 30 |
| TPSA: | 156.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD22751
Formula: C13H14O3N3
Smiles:
COC(=O)CCCOc1cccc(C2=C[N]N=N2)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.31 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 260.27 | Num_heavy_atoms: | 19 |
| TPSA: | 74.35 | NumAromaticRings: | 1 |
