Glycoside
GD016114
Name:
NoneFormula:
C13H21O5N7Smiles:
NCC(O)CNc1nc(N)c2ncn(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
NCC(O)CNc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.62 |
| AlogP: | -3.25 | Num_rotatable_bonds: | 6 |
| MolWt: | 355.36 | Num_heavy_atoms: | 25 |
| TPSA: | 197.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD11640
Formula: C8H12ON7
Smiles:
NCC(O)CNc1nc(N)c2c(n1)[N]C=N2| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | -1.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 222.23 | Num_heavy_atoms: | 16 |
| TPSA: | 136.54 | NumAromaticRings: | 1 |
