Glycoside
GD103900
Name:
NoneFormula:
C17H15O4N6ISmiles:
N#Cc1ccccc1Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
N#Cc1ccccc1Nc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 4 |
| MolWt: | 494.25 | Num_heavy_atoms: | 28 |
| TPSA: | 149.34 | NumAromaticRings: | 3 |
Unique Aglycone
AD43930
Formula: C12H6N6I
Smiles:
N#Cc1ccccc1Nc1nc(I)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 361.13 | Num_heavy_atoms: | 19 |
| TPSA: | 88.06 | NumAromaticRings: | 2 |
