Glycoside
GD085706
Name:
NoneFormula:
C20H28O5N4Smiles:
CC(C)=CCC/C(C)=C/Cn1cnc2c(ncn2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c1=OAglycone:
CC(C)=CCCC(C)=CCn1cnc2c(c1=O)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 7 |
| MolWt: | 404.47 | Num_heavy_atoms: | 29 |
| TPSA: | 122.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD38163
Formula: C15H19ON4
Smiles:
CC(C)=CCCC(C)=CCn1cnc2c(c1=O)N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 2.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 271.34 | Num_heavy_atoms: | 20 |
| TPSA: | 61.35 | NumAromaticRings: | 1 |
