Glycoside
GD136337
Name:
3-acetamido-2,4,6-triiodo-N-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzamideFormula:
C16H19O8N2I3Smiles:
CN=C(O)c1c(I)c(N=C(C)O)c(I)c(OC2OC(CO)C(O)C(O)C2O)c1IAglycone:
CN=C(O)c1c(I)c(O)c(I)c(N=C(C)O)c1ISugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 748.05 | Num_heavy_atoms: | 29 |
| TPSA: | 164.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD55105
Formula: C10H9O3N2I3
Smiles:
CN=C(O)c1c(I)c(O)c(I)c(N=C(C)O)c1I| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | 3.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 585.91 | Num_heavy_atoms: | 18 |
| TPSA: | 85.41 | NumAromaticRings: | 1 |
