Glycoside
GD015499
Name:
NoneFormula:
C17H20O5N6Smiles:
CONc1nc(C#CCCCC#N)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CONc1nc(C#CCCCC#N)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 388.38 | Num_heavy_atoms: | 28 |
| TPSA: | 158.57 | NumAromaticRings: | 2 |
Unique Aglycone
AD11252
Formula: C12H11ON6
Smiles:
CONc1nc(C#CCCCC#N)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 255.26 | Num_heavy_atoms: | 19 |
| TPSA: | 97.29 | NumAromaticRings: | 1 |
