Glycoside
GD024320
Name:
NoneFormula:
C16H21O6N5Smiles:
CONc1nc(C#CCC(C)O)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CONc1nc(C#CCC(C)O)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 379.37 | Num_heavy_atoms: | 27 |
| TPSA: | 155.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD16247
Formula: C11H12O2N5
Smiles:
CONc1nc(C#CCC(C)O)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 246.25 | Num_heavy_atoms: | 18 |
| TPSA: | 93.73 | NumAromaticRings: | 1 |
