Glycoside
GD027705
Name:
NoneFormula:
C11H12O6N2SSmiles:
O=c1[nH]c(=O)n(C2OC(CO)C(O)C2O)c2ccsc12Aglycone:
O=c1[nH]c(=O)c2sccc2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -1.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.29 | Num_heavy_atoms: | 20 |
| TPSA: | 124.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD18178
Formula: C6H4O2N2S
Smiles:
O=c1[nH]c(=O)c2sccc2[nH]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 0 |
| MolWt: | 168.18 | Num_heavy_atoms: | 11 |
| TPSA: | 65.72 | NumAromaticRings: | 2 |
