Glycoside
GD095366
Name:
NoneFormula:
C13H17O5N6SISmiles:
COCNC(=S)Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COCNC(=S)Nc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 496.29 | Num_heavy_atoms: | 26 |
| TPSA: | 146.81 | NumAromaticRings: | 2 |
Unique Aglycone
AD40704
Formula: C8H8ON6SI
Smiles:
COCNC(=S)Nc1nc(I)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 363.16 | Num_heavy_atoms: | 17 |
| TPSA: | 85.53 | NumAromaticRings: | 1 |
