Glycoside
GD008430
Name:
NoneFormula:
C11H14O4N4Smiles:
C[C@@H]1O[C@H](n2cnc(C(N)=O)c2CC#N)[C@H](O)[C@H]1OAglycone:
N#CCC1=C(C(N)=O)N=C[N]1Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 266.26 | Num_heavy_atoms: | 19 |
| TPSA: | 134.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD06673
Formula: C6H5ON4
Smiles:
N#CCC1=C(C(N)=O)N=C[N]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 2 |
| MolWt: | 149.13 | Num_heavy_atoms: | 11 |
| TPSA: | 93.34 | NumAromaticRings: | 0 |
