Glycoside
GD055433
Name:
NoneFormula:
C13H19O8N3Smiles:
COc1ncnc(OC)c1CNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
COc1ncnc(OC)c1CNSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -3.25 | Num_rotatable_bonds: | 9 |
| MolWt: | 345.31 | Num_heavy_atoms: | 24 |
| TPSA: | 171.33 | NumAromaticRings: | 1 |
Unique Aglycone
AD28058
Formula: C7H11O2N3
Smiles:
COc1ncnc(OC)c1CN| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 169.18 | Num_heavy_atoms: | 12 |
| TPSA: | 70.26 | NumAromaticRings: | 1 |
