Glycoside
GD057535
Name:
NoneFormula:
C12H18O7N2SSmiles:
COc1nc(C)c(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)s1Aglycone:
COc1nc(C)c(C(N)=O)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 334.35 | Num_heavy_atoms: | 22 |
| TPSA: | 141.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD28857
Formula: C6H8O2N2S
Smiles:
COc1nc(C)c(C(N)=O)s1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 172.21 | Num_heavy_atoms: | 11 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
