Glycoside
GD088750
Name:
NoneFormula:
C16H26O6N6SSmiles:
CCN(CCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)S(C)(=O)=OAglycone:
CCN(CCCNc1ncnc2c1N=C[N]2)S(C)(=O)=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 9 |
| MolWt: | 430.49 | Num_heavy_atoms: | 29 |
| TPSA: | 162.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD38831
Formula: C11H17O2N6S
Smiles:
CCN(CCCNc1ncnc2c1N=C[N]2)S(C)(=O)=O| HBA: | 8 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 297.36 | Num_heavy_atoms: | 20 |
| TPSA: | 101.65 | NumAromaticRings: | 1 |
