Glycoside
GD053172
Name:
NoneFormula:
C13H19O6N3SSmiles:
CSc1nc(N[C@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(C(C)=O)c(=O)n1CAglycone:
CSc1nc(N)c(C(C)=O)c(=O)n1CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 345.38 | Num_heavy_atoms: | 23 |
| TPSA: | 133.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD27244
Formula: C8H11O2N3S
Smiles:
CSc1nc(N)c(C(C)=O)c(=O)n1C| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 2 |
| MolWt: | 213.26 | Num_heavy_atoms: | 14 |
| TPSA: | 77.98 | NumAromaticRings: | 1 |
