Glycoside
GD029110
Name:
NoneFormula:
C12H18O4N4SSmiles:
CSC[C@@H]1O[C@H](n2cnc3c2N=CNC[C@H]3O)[C@H](O)[C@H]1OAglycone:
OC1CNC=NC2=C1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.37 | Num_heavy_atoms: | 21 |
| TPSA: | 112.13 | NumAromaticRings: | 1 |
Unique Aglycone
AD03209
Formula: C6H7ON4
Smiles:
OC1CNC=NC2=C1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 151.15 | Num_heavy_atoms: | 11 |
| TPSA: | 71.08 | NumAromaticRings: | 0 |
