Glycoside
GD052274
Name:
NoneFormula:
C13H17O5N5Smiles:
CC(C)=Nc1ncnc2c1[nH]c(=O)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC(C)=Nc1ncnc2[nH]c(=O)[nH]c12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | -1.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 323.31 | Num_heavy_atoms: | 23 |
| TPSA: | 145.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD27133
Formula: C8H9ON5
Smiles:
CC(C)=Nc1ncnc2[nH]c(=O)[nH]c12| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 191.19 | Num_heavy_atoms: | 14 |
| TPSA: | 86.79 | NumAromaticRings: | 2 |
