Glycoside
GD063873
Name:
NoneFormula:
C14H20O5N6Smiles:
CCn1cc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1Aglycone:
CCn1cc(NC2=C(C(N)=O)N=C[N]2)cn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 352.35 | Num_heavy_atoms: | 25 |
| TPSA: | 160.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD30725
Formula: C9H11ON6
Smiles:
CCn1cc(NC2=C(C(N)=O)N=C[N]2)cn1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | -0.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 219.23 | Num_heavy_atoms: | 16 |
| TPSA: | 99.4 | NumAromaticRings: | 1 |
