Glycoside
GD012082
Name:
NoneFormula:
C16H24O6N8Smiles:
N=C(N)NCCCNC(=O)c1cn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2nc(N)nc(O)c12Aglycone:
N=C(N)NCCCNC(=O)C1=C[N]c2nc(N)nc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.5 |
| AlogP: | -3.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 424.42 | Num_heavy_atoms: | 30 |
| TPSA: | 237.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD09131
Formula: C11H15O2N8
Smiles:
N=C(N)NCCCNC(=O)C1=C[N]c2nc(N)nc(O)c21| HBA: | 10 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.27 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 291.3 | Num_heavy_atoms: | 21 |
| TPSA: | 177.13 | NumAromaticRings: | 1 |
