Glycoside
GD070098
Name:
NoneFormula:
C17H16O6N4Smiles:
O=Cc1cccc(Oc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
O=Cc1cccc(Oc2ncnc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 372.34 | Num_heavy_atoms: | 27 |
| TPSA: | 139.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD33199
Formula: C12H7O2N4
Smiles:
O=Cc1cccc(Oc2ncnc3c2N=C[N]3)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 3 |
| MolWt: | 239.21 | Num_heavy_atoms: | 18 |
| TPSA: | 78.54 | NumAromaticRings: | 2 |
