Glycoside
GD066203
Name:
NoneFormula:
C14H13O8N3Smiles:
O=C(Nc1cccc2c1C(=O)N=NC2=O)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1cccc2c1C(=O)N=NC2=OSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 351.27 | Num_heavy_atoms: | 25 |
| TPSA: | 185.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD31751
Formula: C8H5O2N3
Smiles:
Nc1cccc2c1C(=O)N=NC2=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 0 |
| MolWt: | 175.15 | Num_heavy_atoms: | 13 |
| TPSA: | 84.88 | NumAromaticRings: | 1 |
