Glycoside
GD053179
Name:
NoneFormula:
C13H19O7N3Smiles:
COc1nc(N[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(C(C)=O)c(=O)n1CAglycone:
COc1nc(N)c(C(C)=O)c(=O)n1CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -2.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.31 | Num_heavy_atoms: | 23 |
| TPSA: | 143.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD27246
Formula: C8H11O3N3
Smiles:
COc1nc(N)c(C(C)=O)c(=O)n1C| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 197.19 | Num_heavy_atoms: | 14 |
| TPSA: | 87.21 | NumAromaticRings: | 1 |
