Glycoside
GD094979
Name:
NoneFormula:
C14H18O6N5ISmiles:
CC(C)n1nc(I)c2c(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)ncnc21Aglycone:
CC(C)n1nc(I)c2c(N)ncnc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 479.23 | Num_heavy_atoms: | 26 |
| TPSA: | 170.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD40583
Formula: C8H10N5I
Smiles:
CC(C)n1nc(I)c2c(N)ncnc21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 1 |
| MolWt: | 303.11 | Num_heavy_atoms: | 14 |
| TPSA: | 69.62 | NumAromaticRings: | 2 |
