Glycoside
GD075811
Name:
NoneFormula:
C17H27O4N6Smiles:
C[C@H]1[C@H]([NH+](C)C)CCN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC1C([NH+](C)C)CCN1c1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -2.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 379.44 | Num_heavy_atoms: | 27 |
| TPSA: | 121.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD35109
Formula: C12H18N6
Smiles:
CC1C([NH+](C)C)CCN1c1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.32 | Num_heavy_atoms: | 18 |
| TPSA: | 59.92 | NumAromaticRings: | 1 |
