Glycoside
GD054680
Name:
NoneFormula:
C12H25O8NSSmiles:
CCOCCS(=O)(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CCOCCS(=O)(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 9 |
| MolWt: | 343.4 | Num_heavy_atoms: | 22 |
| TPSA: | 134.55 | NumAromaticRings: | 0 |
Unique Aglycone
AD27868
Formula: C6H15O4NS
Smiles:
CCOCCS(=O)(=O)NCCO| HBA: | 5 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 197.26 | Num_heavy_atoms: | 12 |
| TPSA: | 75.63 | NumAromaticRings: | 0 |
