Glycoside
GD099397
Name:
NoneFormula:
C14H16O6N5ISmiles:
C=CCOC(=O)Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C=CCOC(=O)Nc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 477.22 | Num_heavy_atoms: | 26 |
| TPSA: | 151.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD42270
Formula: C9H7O2N5I
Smiles:
C=CCOC(=O)Nc1nc(I)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 344.09 | Num_heavy_atoms: | 17 |
| TPSA: | 90.57 | NumAromaticRings: | 1 |
