Glycoside
GD071116
Name:
NoneFormula:
C10H13O6N2ISmiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cc(I)c(=O)[nH]c1=OAglycone:
O=c1[nH]cc(I)c(=O)[nH]1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | -1.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 384.13 | Num_heavy_atoms: | 19 |
| TPSA: | 113.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD00569
Formula: C4H3O2N2I
Smiles:
O=c1[nH]cc(I)c(=O)[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 0 |
| MolWt: | 237.98 | Num_heavy_atoms: | 9 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
