Glycoside
GD091262
Name:
NoneFormula:
C18H27O7N5Smiles:
CC(C)(C)OC(=O)N1CC=C(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
CC(C)(C)OC(=O)N1CC=C(NC2=C(C(N)=O)N=C[N]2)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.44 | Num_heavy_atoms: | 30 |
| TPSA: | 172.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD39797
Formula: C13H18O3N5
Smiles:
CC(C)(C)OC(=O)N1CC=C(NC2=C(C(N)=O)N=C[N]2)C1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.32 | Num_heavy_atoms: | 21 |
| TPSA: | 111.12 | NumAromaticRings: | 0 |
