Glycoside
GD124859
Name:
NoneFormula:
C18H26O12N8Smiles:
[O-][NH+](O)c1ccc(NN=CC(=NNc2ccc([NH+]([O-])O)cc2[NH+]([O-])O)C(O)C(O)C(O)CO)c([NH+]([O-])O)c1Aglycone:
[O-][NH+](O)c1ccc(NN=CC=NNc2ccc([NH+]([O-])O)cc2[NH+]([O-])O)c([NH+]([O-])O)c1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 2 |
| HBD: | 14 | FractionCSP3: | 0.22 |
| AlogP: | -5.76 | Num_rotatable_bonds: | 13 |
| MolWt: | 546.45 | Num_heavy_atoms: | 38 |
| TPSA: | 320.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD50468
Formula: C14H18O8N8
Smiles:
[O-][NH+](O)c1ccc(NN=CC=NNc2ccc([NH+]([O-])O)cc2[NH+]([O-])O)c([NH+]([O-])O)c1| HBA: | 16 | RingCount: | 2 |
| HBD: | 10 | FractionCSP3: | 0.0 |
| AlogP: | -3.2 | Num_rotatable_bonds: | 9 |
| MolWt: | 426.35 | Num_heavy_atoms: | 30 |
| TPSA: | 239.7 | NumAromaticRings: | 2 |
