Glycoside
GD071114
Name:
NoneFormula:
C10H14O5N3ISmiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cc(I)c(N)nc1=OAglycone:
Nc1nc(=O)[nH]cc1ISugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 383.14 | Num_heavy_atoms: | 19 |
| TPSA: | 119.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD07267
Formula: C4H4ON3I
Smiles:
Nc1nc(=O)[nH]cc1I| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 0 |
| MolWt: | 237.0 | Num_heavy_atoms: | 9 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
