Glycoside
GD144017
Name:
NoneFormula:
C18H31O6N2ClSSmiles:
CCCC1CNC(C(O)=NC(C(C)Cl)C2OC(S(C)=O)C(O)C(O)C2O)C1Aglycone:
CCCC1CNC(C(O)=NCC(C)Cl)C1Sugarmoiety:
CS(=O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 7 |
| MolWt: | 426.96 | Num_heavy_atoms: | 27 |
| TPSA: | 131.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD50616
Formula: C12H21ON2Cl
Smiles:
CCCC1CNC(C(O)=NCC(C)Cl)C1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.91 |
| AlogP: | 2.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 232.75 | Num_heavy_atoms: | 15 |
| TPSA: | 44.62 | NumAromaticRings: | 0 |
