C1CSSC1CCCCC(=O)O
Name: 5-[(3R)-dithiolan-3-yl]pentanoic acid
SMILES: C1CSSC1CCCCC(=O)O

Molecular Processing

Molecular formula
C8H14O2S2
Molecular weight
206.33
Exact mass
206.0435
XLogP
2.79
TPSA
37.3
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
12
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.875
Molar refractivity
54.56

Supplementary Information

InChIKey: AGBQKNBQESQNJD-SSDOTTSWSA-N
Synonyms
lipoic acid(R)-lipoic acid(R)-5-(1,2-Dithiolan-3-yl)pentanoic acid(R)-alpha-Lipoic acidD-Thioctic acid1,2-Dithiolane-3-pentanoic acid, (3R)-(R)-(+)-1,2-Dithiolane-3-pentanoic acid(+)-alpha-Lipoic acidThioctic acid d-formR-(+)-Thioctic acid5-[(3R)-dithiolan-3-yl]pentanoic acidR-alpha-Lipoic acidBerlitionThiogammaLipoecTiobec5-[(3R)-1,2-dithiolan-3-yl]pentanoic acidR-Lipoic acid(R)-(+)-lipoic acid(R)-1,2-Dithiolane-3-pentanoic acid(R)-6,8-thioctic acid(R)-(+)-a-Lipoic acid(R)-1,2-Dithiolane-3-valeric Acidalpha-(+)-Lipoic acid1,2-Dithiolane-3R-pentanoic acidMFCD01631142(r)-(+)-alpha-lipoic acidR-(+)-Lipoic acidLipoic acid (Standard)R-LA
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Involved in 49 reactions→

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