Glycoside
GD058301
Name:
NoneFormula:
C14H17O5N5Smiles:
CCOc1c(C#N)c2c(N)ncnc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOC1=C(C#N)c2c(N)ncnc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.1 | Num_rotatable_bonds: | 4 |
| MolWt: | 335.32 | Num_heavy_atoms: | 24 |
| TPSA: | 159.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD29170
Formula: C9H8ON5
Smiles:
CCOC1=C(C#N)c2c(N)ncnc2[N]1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 202.2 | Num_heavy_atoms: | 15 |
| TPSA: | 98.92 | NumAromaticRings: | 1 |
