Glycoside
GD063896
Name:
NoneFormula:
C13H17O6N5SSmiles:
COc1ncc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)s1Aglycone:
COc1ncc(NC2=C(C(N)=O)N=C[N]2)s1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 6 |
| MolWt: | 371.38 | Num_heavy_atoms: | 25 |
| TPSA: | 164.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD30739
Formula: C8H8O2N5S
Smiles:
COc1ncc(NC2=C(C(N)=O)N=C[N]2)s1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 238.25 | Num_heavy_atoms: | 16 |
| TPSA: | 103.7 | NumAromaticRings: | 1 |
