Glycoside
GD097515
Name:
NoneFormula:
C21H29O7N5Smiles:
CCN(CC)C(=O)c1ccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(OC)c1Aglycone:
CCN(CC)C(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)c(OC)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.48 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 9 |
| MolWt: | 463.49 | Num_heavy_atoms: | 33 |
| TPSA: | 172.4 | NumAromaticRings: | 2 |
Unique Aglycone
AD41478
Formula: C16H20O3N5
Smiles:
CCN(CC)C(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)c(OC)c1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 7 |
| MolWt: | 330.37 | Num_heavy_atoms: | 24 |
| TPSA: | 111.12 | NumAromaticRings: | 1 |
