Glycoside
GD008815
Name:
NoneFormula:
C14H17O5N5Smiles:
CONc1ncnc2c1c(C#N)cn2C1O[C@H](CO)[C@H](O)[C@]1(C)OAglycone:
CONc1ncnc2c1C(C#N)=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 335.32 | Num_heavy_atoms: | 24 |
| TPSA: | 145.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD06992
Formula: C8H6ON5
Smiles:
CONc1ncnc2c1C(C#N)=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 188.17 | Num_heavy_atoms: | 14 |
| TPSA: | 84.93 | NumAromaticRings: | 1 |
