Glycoside
GD071316
Name:
NoneFormula:
C15H24O8NFSSmiles:
C[C@@H](Cc1ccccc1F)N[C@H]1[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]1OAglycone:
CC(N)Cc1ccccc1F.COS(O)(O)OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.6 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 7 |
| MolWt: | 397.42 | Num_heavy_atoms: | 26 |
| TPSA: | 151.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD12993
Formula: CH6O4S
Smiles:
COS(O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 1 |
| MolWt: | 114.12 | Num_heavy_atoms: | 6 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
AD26848
Formula: C9H12NF
Smiles:
CC(N)Cc1ccccc1F| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 153.2 | Num_heavy_atoms: | 11 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
