Glycoside
GD095175
Name:
NoneFormula:
C13H15O6N4ISmiles:
Cn1cc(I)c2c(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)ncnc21Aglycone:
Cn1cc(I)c2c(N)ncnc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 450.19 | Num_heavy_atoms: | 24 |
| TPSA: | 157.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD40633
Formula: C7H7N4I
Smiles:
Cn1cc(I)c2c(N)ncnc21| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 0 |
| MolWt: | 274.06 | Num_heavy_atoms: | 12 |
| TPSA: | 56.73 | NumAromaticRings: | 2 |
