Glycoside
GD005451
Name:
NoneFormula:
C19H21O6N5Smiles:
COc1cccc(-c2c(C(N)=O)c3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1Aglycone:
COc1cccc(C2=C(C(N)=O)c3c(N)ncnc3[N]2)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.32 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 415.41 | Num_heavy_atoms: | 30 |
| TPSA: | 178.97 | NumAromaticRings: | 3 |
Unique Aglycone
AD04632
Formula: C14H12O2N5
Smiles:
COc1cccc(C2=C(C(N)=O)c3c(N)ncnc3[N]2)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 282.28 | Num_heavy_atoms: | 21 |
| TPSA: | 118.22 | NumAromaticRings: | 2 |
