Glycoside
GD036081
Name:
NoneFormula:
C26H29O8N3Smiles:
CCOc1ccc(C=CC(=O)c2ccc(OCc3cn([C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)nn3)cc2)cc1Aglycone:
CCOc1ccc(C=CC(=O)c2ccc(OCC3=C[N]N=N3)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 10 |
| MolWt: | 511.53 | Num_heavy_atoms: | 37 |
| TPSA: | 156.39 | NumAromaticRings: | 3 |
Unique Aglycone
AD22791
Formula: C20H18O3N3
Smiles:
CCOc1ccc(C=CC(=O)c2ccc(OCC3=C[N]N=N3)cc2)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.15 |
| AlogP: | 4.19 | Num_rotatable_bonds: | 8 |
| MolWt: | 348.38 | Num_heavy_atoms: | 26 |
| TPSA: | 74.35 | NumAromaticRings: | 2 |
