Glycoside
GD088471
Name:
NoneFormula:
C17H31O9NSSmiles:
COCCC1(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)CCS(=O)(=O)CC1Aglycone:
COCCC1(C(=O)NCCO)CCS(=O)(=O)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | -1.82 | Num_rotatable_bonds: | 8 |
| MolWt: | 425.5 | Num_heavy_atoms: | 28 |
| TPSA: | 151.62 | NumAromaticRings: | 0 |
Unique Aglycone
AD38702
Formula: C11H21O5NS
Smiles:
COCCC1(C(=O)NCCO)CCS(=O)(=O)CC1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.91 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 6 |
| MolWt: | 279.36 | Num_heavy_atoms: | 18 |
| TPSA: | 92.7 | NumAromaticRings: | 0 |
