Glycoside
GD027956
Name:
NoneFormula:
C12H17O7N2ISmiles:
COC(CI)c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]c1=OAglycone:
COC(CI)c1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 5 |
| MolWt: | 428.18 | Num_heavy_atoms: | 22 |
| TPSA: | 134.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD12848
Formula: C7H9O3N2I
Smiles:
COC(CI)c1c[nH]c(=O)[nH]c1=O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 296.06 | Num_heavy_atoms: | 13 |
| TPSA: | 74.95 | NumAromaticRings: | 1 |
