Glycoside
GD054753
Name:
NoneFormula:
C12H17O8N3Smiles:
COc1ncnc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c1OCAglycone:
COc1ncnc(N)c1OCSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.92 | Num_rotatable_bonds: | 8 |
| MolWt: | 331.28 | Num_heavy_atoms: | 23 |
| TPSA: | 171.33 | NumAromaticRings: | 1 |
Unique Aglycone
AD25672
Formula: C6H9O2N3
Smiles:
COc1ncnc(N)c1OC| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 155.16 | Num_heavy_atoms: | 11 |
| TPSA: | 70.26 | NumAromaticRings: | 1 |
