Thia fatty acids

Description:

Fatty acid derivatives obtained by insertion of a sulfur atom at specific positions in the chain.

Ancestors:

Organic compounds ⮕ Lipids and lipid-like molecules ⮕ Fatty Acyls ⮕ Fatty acids and conjugates ⮕ Thia fatty acids

3-sulfanylbutanoic acid
- ≥99%
Cas Number: 26473-49-4

Formula: C₄H₈O₂S Molecular Weight: 120.17

SMILES: CC(CC(=O)O)S

InChIKey: RQPNXPWEGVCPCX-UHFFFAOYSA-N

InChI: InChI=1S/C4H8O2S/c1-3(7)2-4(5)6/h3,7H,2H2,1H3,(H,5,6)
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3-sulfanylbutanoic acid
- ≥95%
Cas Number: 26473-49-4

Formula: C₄H₈O₂S Molecular Weight: 120.17

SMILES: CC(CC(=O)O)S

InChIKey: RQPNXPWEGVCPCX-UHFFFAOYSA-N

InChI: InChI=1S/C4H8O2S/c1-3(7)2-4(5)6/h3,7H,2H2,1H3,(H,5,6)
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5-Mercaptopentanoic Acid
- ≥95%
Cas Number: 30247-98-4 Compound CID: 10909614

Formula: C₅H₁₀O₂S Molecular Weight: 134.2

IUPAC Name: 5-sulfanylpentanoic acid

SMILES: C(CCS)CC(=O)O

InChIKey: GCIZMJUHGHGRNW-UHFFFAOYSA-N

InChI: InChI=1S/C5H10O2S/c6-5(7)3-1-2-4-8/h8H,1-4H2,(H,6,7)

Synonyms: 5-sulfanylpentanoic Acid
Details

Pricing Close
(S)-3-((tert-Butoxycarbonyl)amino)-5-(methylthio)pentanoic acid
- ≥97%
Cas Number: 1217811-51-2 Compound CID: 2761534

Formula: C₁₁H₂₁NO₄S Molecular Weight: 263.36

IUPAC Name: (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-methylsulfanylpentanoic acid

SMILES: CC(C)(C)OC(=O)NC(CCSC)CC(=O)O

InChIKey: HBFKPNZCUUZRLA-MRVPVSSYSA-N

InChI: InChI=1S/C11H21NO4S/c1-11(2,3)16-10(15)12-8(5-6-17-4)7-9(13)14/h8H,5-7H2,1-4H3,(H,12,15)(H,13,14)/t8-/m1/s1
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2-(thietan-3-yl)acetic acid
- ≥97%
Cas Number: 1425935-32-5 Compound CID: 82593826

Formula: C₅H₈O₂S Molecular Weight: 132.18

SMILES: C1C(CS1)CC(=O)O

InChIKey: GPJDZMWQGWVIDL-UHFFFAOYSA-N

InChI: InChI=1S/C5H8O2S/c6-5(7)1-4-2-8-3-4/h4H,1-3H2,(H,6,7)
Details

Pricing Close
PPA
- ≥99%
Cas Number: 452072-22-9 EC Number: 630-611-3 Compound CID: 11536061

Formula: C₁₀H₁₃NO₂S₂ Molecular Weight: 243.35

IUPAC Name: 4-(pyridin-2-yldisulfanyl)pentanoic acid

SMILES: CC(CCC(=O)O)SSC1=CC=CC=N1

InChIKey: OOUPHXWHXYLQBK-UHFFFAOYSA-N

InChI: InChI=1S/C10H13NO2S2/c1-8(5-6-10(12)13)14-15-9-4-2-3-7-11-9/h2-4,7-8H,5-6H2,1H3,(H,12,13)

Synonyms: SCHEMBL16132816 | BP-23701 | CS-0197881 | MS-23445 | 4-(2-Pyridinyldithio)pentanoic acid | (S)-4-(pyridin-2-yldisulfa...
Details

Pricing Close
3-methylsulfanylbicyclo[1.1.1]pentane-1-carboxylic acid
- ≥97%
Cas Number: 2387598-76-5 Compound CID: 145944955

Formula: C₇H₁₀O₂S Molecular Weight: 158.22

IUPAC Name: 3-methylsulfanylbicyclo[1.1.1]pentane-1-carboxylic acid

SMILES: CSC12CC(C1)(C2)C(=O)O

InChIKey: AXEXKAMBPMWYPE-UHFFFAOYSA-N

InChI: InChI=1S/C7H10O2S/c1-10-7-2-6(3-7,4-7)5(8)9/h2-4H2,1H3,(H,8,9)

Synonyms: 3-methylsulfanylbicyclo[1.1.1]pentane-1-carboxylic acid | 2387598-76-5 | 3-methylsulfanylbicyclo[1.1.1]pentane-1-carb...
Details

Pricing Close
4-Mercapto-4-methylpentanoic acid
- ≥97%
Cas Number: 140231-31-8 EC Number: ‘820-450-9

Formula: C₆H₁₂O₂S Molecular Weight: 148.23

IUPAC Name: 4-methyl-4-sulfanylpentanoic acid

SMILES: CC(C)(CCC(=O)O)S

InChIKey: SYIFSIGCMOMQRB-UHFFFAOYSA-N

InChI: InChI=1S/C6H12O2S/c1-6(2,9)4-3-5(7)8/h9H,3-4H2,1-2H3,(H,7,8)

Synonyms: 4-Mercapto-4-methylpentanoicacid | MFCD18451989 | A902986 | BP-22000 | 4-Mercapto-4-methylpentanoic acid | 4-mercapto...
Details

Pricing Close
4-[[[(2-Carboxyethyl)thio]thioxomethyl]thio]-4-cyanopentanoic acid
- ≥95%
Cas Number: 2055041-03-5

Formula: C₁₀H₁₃NO₄S₃ Molecular Weight: 307.41

IUPAC Name: 4-(2-carboxyethylsulfanylcarbothioylsulfanyl)-4-cyanopentanoic acid

SMILES: CC(CCC(=O)O)(C#N)SC(=S)SCCC(=O)O

InChIKey: CTLAWKZAJCYIFX-UHFFFAOYSA-N

InChI: InChI=1S/C10H13NO4S3/c1-10(6-11,4-2-7(12)13)18-9(16)17-5-3-8(14)15/h2-5H2,1H3,(H,12,13)(H,14,15)

Synonyms: 4-[[[(2-Carboxyethyl)thio]thioxomethyl]thio]-4-cyanopentanoic acid | SCHEMBL18586309 | 4-((((2-Carboxyethyl)thio)carb...
Details

Pricing Close
α-Keto-γ-(methylthio)butyric acid sodium salt
- ≥97%
Cas Number: 51828-97-8

Formula: C₅H₇O₃SNa Molecular Weight: 170.16

IUPAC Name: sodium;4-methylsulfanyl-2-oxobutanoate

SMILES: CSCCC(=O)C(=O)[O-].[Na+]

InChIKey: IFSCKRWNXKWTLR-UHFFFAOYSA-M

InChI: InChI=1S/C5H8O3S.Na/c1-9-3-2-4(6)5(7)8;/h2-3H2,1H3,(H,7,8);/q;+1/p-1

Synonyms: 2EZY36W75U | HY-135046 | Q27254641 | 4-Methylthio-2-oxobutanoic acid [FHFI] | Sodium 4-(methylthio)-2-oxobutanoate | ...
Details

Pricing Close
4-mercaptobutyric acid
- ≥95%
Cas Number: 13095-73-3

Formula: C₄H₈O₂S Molecular Weight: 120.17

IUPAC Name: 4-sulfanylbutanoic acid

SMILES: C(CC(=O)O)CS

InChIKey: DTRIDVOOPAQEEL-UHFFFAOYSA-N

InChI: InChI=1S/C4H8O2S/c5-4(6)2-1-3-7/h7H,1-3H2,(H,5,6)

Synonyms: CHEBI:138400 | DTRIDVOOPAQEEL-UHFFFAOYSA-N | AM20080221 | 4-Thiobutyric Acid | F20547 | FT-0671084 | gamma-sulfanylbu...
Details

Pricing Close
Sulfosuccinic acid
- 70 wt. % in H2O
Cas Number: 5138-18-1 Compound CID: 21220

Formula: HOOCCH₂CH(SO₃H)COOH Molecular Weight: 198.15

IUPAC Name: 2-sulfobutanedioic acid

SMILES: C(C(C(=O)O)S(=O)(=O)O)C(=O)O

InChIKey: ULUAUXLGCMPNKK-UHFFFAOYSA-N

InChI: InChI=1S/C4H6O7S/c5-3(6)1-2(4(7)8)12(9,10)11/h2H,1H2,(H,5,6)(H,7,8)(H,9,10,11)

Synonyms: sulfobutanedioic acid | Sulphosuccinic acid | 2-Sulfobutanedioic acid | 2-Sulfosuccinic acid
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