Glycoside
GD101660
Name:
NoneFormula:
C16H16O5N5ISmiles:
O=c1ccc(Nc2ncnc3c2c(I)cn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c[nH]1Aglycone:
O=c1ccc(Nc2ncnc3c2C(I)=C[N]3)c[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 485.24 | Num_heavy_atoms: | 27 |
| TPSA: | 145.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD43040
Formula: C11H7ON5I
Smiles:
O=c1ccc(Nc2ncnc3c2C(I)=C[N]3)c[nH]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 352.11 | Num_heavy_atoms: | 18 |
| TPSA: | 84.77 | NumAromaticRings: | 2 |
