Glycoside
GD066338
Name:
NoneFormula:
C16H21O7NSSmiles:
COc1cccc2c1SC[C@H](NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)C2Aglycone:
COc1cccc2c1SCC(N)C2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 7 |
| MolWt: | 371.41 | Num_heavy_atoms: | 25 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD31785
Formula: C10H13ONS
Smiles:
COc1cccc2c1SCC(N)C2| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 195.29 | Num_heavy_atoms: | 13 |
| TPSA: | 35.25 | NumAromaticRings: | 1 |
