CCCCCC(O)CCCC(CCCCCCC(=O)O)S(C)(=O)=O
SMILES: CCCCCC(O)CCCC(CCCCCCC(=O)O)S(C)(=O)=O

Molecular Processing

Molecular formula
C18H36O5S
Molecular weight
364.55
Exact mass
364.2283
XLogP
3.94
TPSA
91.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
16
Heavy atoms
24
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.944
Molar refractivity
97.97

Supplementary Information

詳細情報を取得中…

21 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→