Glycoside
GD103916
Name:
NoneFormula:
C25H30O5N6Smiles:
C=C1CC(C)(C(=O)N(CCc2ccc(N)cc2)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
C=C1CC(C)(C(=O)N(CCc2ccc(N)cc2)c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 7 |
| MolWt: | 494.55 | Num_heavy_atoms: | 36 |
| TPSA: | 159.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD43941
Formula: C20H21ON6
Smiles:
C=C1CC(C)(C(=O)N(CCc2ccc(N)cc2)c2ncnc3c2N=C[N]3)C1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 361.43 | Num_heavy_atoms: | 27 |
| TPSA: | 98.57 | NumAromaticRings: | 2 |
