Glycoside
GD054920
Name:
NoneFormula:
C14H19O7NSSmiles:
CN(CCC(=O)c1cccs1)C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
CNCCC(=O)c1cccs1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.58 | Num_rotatable_bonds: | 9 |
| MolWt: | 345.37 | Num_heavy_atoms: | 23 |
| TPSA: | 135.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD27932
Formula: C8H11ONS
Smiles:
CNCCC(=O)c1cccs1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 169.25 | Num_heavy_atoms: | 11 |
| TPSA: | 29.1 | NumAromaticRings: | 1 |
