Glycoside
GD016819
Name:
NoneFormula:
C17H26O5N6Smiles:
Nc1nc(NCCC2CCOCC2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(NCCC2CCOCC2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 394.43 | Num_heavy_atoms: | 28 |
| TPSA: | 160.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD12063
Formula: C12H17ON6
Smiles:
Nc1nc(NCCC2CCOCC2)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 261.31 | Num_heavy_atoms: | 19 |
| TPSA: | 99.52 | NumAromaticRings: | 1 |
