Glycoside
GD101627
Name:
NoneFormula:
C20H28O7N6Smiles:
CN(C(=O)OC(C)(C)C)c1ccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1Aglycone:
CN(C(=O)OC(C)(C)C)c1ccc(NC2=C(C(N)=O)N=C[N]2)cn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 464.48 | Num_heavy_atoms: | 33 |
| TPSA: | 185.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD43020
Formula: C15H19O3N6
Smiles:
CN(C(=O)OC(C)(C)C)c1ccc(NC2=C(C(N)=O)N=C[N]2)cn1| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 331.36 | Num_heavy_atoms: | 24 |
| TPSA: | 124.01 | NumAromaticRings: | 1 |
