Glycoside
GD091848
Name:
NoneFormula:
C14H18O5N3ISmiles:
Cc1cn2ccc(I)c(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2n1Aglycone:
Cc1cn2ccc(I)c(N)c2n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 3 |
| MolWt: | 435.22 | Num_heavy_atoms: | 23 |
| TPSA: | 119.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD40054
Formula: C8H8N3I
Smiles:
Cc1cn2ccc(I)c(N)c2n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 0 |
| MolWt: | 273.08 | Num_heavy_atoms: | 12 |
| TPSA: | 43.32 | NumAromaticRings: | 2 |
