Glycoside
GD053849
Name:
NoneFormula:
C14H25O5N4Smiles:
OC[C@H]1O[C@H](O)[C@H](n2cc(C[NH+]3CCCCC3)nn2)[C@@H](O)[C@@H]1OAglycone:
C1=C(C[NH+]2CCCCC2)N=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -3.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.38 | Num_heavy_atoms: | 23 |
| TPSA: | 125.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD27443
Formula: C8H14N4
Smiles:
C1=C(C[NH+]2CCCCC2)N=N[N]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 166.23 | Num_heavy_atoms: | 12 |
| TPSA: | 43.26 | NumAromaticRings: | 0 |
