Glycoside
GD047158
Name:
NoneFormula:
C12H17O7N3Smiles:
COc1nc(N[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(C=O)c(=O)n1CAglycone:
COc1nc(N)c(C=O)c(=O)n1CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -2.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 315.28 | Num_heavy_atoms: | 22 |
| TPSA: | 143.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD25448
Formula: C7H9O3N3
Smiles:
COc1nc(N)c(C=O)c(=O)n1C| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 183.17 | Num_heavy_atoms: | 13 |
| TPSA: | 87.21 | NumAromaticRings: | 1 |
