Glycoside
GD016046
Name:
NoneFormula:
C13H18O7N8Smiles:
[N-]=[N+]=NCC(O)Cn1c(=O)n(C2OC(CO)[C@H](O)[C@H]2O)c2nc(N)nc(O)c21Aglycone:
[N-]=[N+]=NCC(O)Cn1c(=O)[nH]c2nc(N)nc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.62 |
| AlogP: | -2.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 398.34 | Num_heavy_atoms: | 28 |
| TPSA: | 237.87 | NumAromaticRings: | 2 |
Unique Aglycone
AD11596
Formula: C8H10O3N8
Smiles:
[N-]=[N+]=NCC(O)Cn1c(=O)[nH]c2nc(N)nc(O)c21| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 266.22 | Num_heavy_atoms: | 19 |
| TPSA: | 178.81 | NumAromaticRings: | 2 |
