Glycoside
GD013908
Name:
NoneFormula:
C22H27O5N5Smiles:
CCCOc1ccc2c(c1)CCC2Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCCOc1ccc2c(c1)CCC2Nc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 7 |
| MolWt: | 441.49 | Num_heavy_atoms: | 32 |
| TPSA: | 134.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD10310
Formula: C17H18ON5
Smiles:
CCCOc1ccc2c(c1)CCC2Nc1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 5 |
| MolWt: | 308.37 | Num_heavy_atoms: | 23 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |
