Glycoside
GD098724
Name:
NoneFormula:
C15H18O5N5ISmiles:
O=C(Nc1ncnc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)NC1CC1Aglycone:
O=C(Nc1ncnc2c1C(I)=C[N]2)NC1CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 475.24 | Num_heavy_atoms: | 26 |
| TPSA: | 141.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD41995
Formula: C10H9ON5I
Smiles:
O=C(Nc1ncnc2c1C(I)=C[N]2)NC1CC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 342.12 | Num_heavy_atoms: | 17 |
| TPSA: | 81.01 | NumAromaticRings: | 1 |
