Glycoside
GD006828
Name:
NoneFormula:
C12H15O5N6ISmiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NOC)nc(I)nc32)[C@H](O)[C@H]1OAglycone:
CONc1nc(I)nc2c1N=C[N]2Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 450.19 | Num_heavy_atoms: | 24 |
| TPSA: | 143.65 | NumAromaticRings: | 2 |
Unique Aglycone
AD05609
Formula: C6H5ON5I
Smiles:
CONc1nc(I)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 290.04 | Num_heavy_atoms: | 13 |
| TPSA: | 73.5 | NumAromaticRings: | 1 |
