Glycoside
GD016781
Name:
NoneFormula:
C15H18O6N6Smiles:
N#CCCNC(=O)c1cn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2nc(N)nc(O)c12Aglycone:
N#CCCNC(=O)C1=C[N]c2nc(N)nc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.47 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 378.35 | Num_heavy_atoms: | 27 |
| TPSA: | 199.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD12042
Formula: C10H9O2N6
Smiles:
N#CCCNC(=O)C1=C[N]c2nc(N)nc(O)c21| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.2 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 245.22 | Num_heavy_atoms: | 18 |
| TPSA: | 139.02 | NumAromaticRings: | 1 |
