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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > dicarboxylic acid anion > dicarboxylic acid monoanion > thiomalate(1-) > 3-carboxy-3-mercaptopropanoate
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > dicarboxylic acid anion > dicarboxylic acid monoanion > thiomalate(1-) > 3-carboxy-3-mercaptopropanoate
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic anion > oxoanion > carboxylic acid anion > dicarboxylic acid anion > dicarboxylic acid monoanion > thiomalate(1-) > 3-carboxy-3-mercaptopropanoate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxide > oxoanion > carboxylic acid anion > dicarboxylic acid anion > dicarboxylic acid monoanion > thiomalate(1-) > 3-carboxy-3-mercaptopropanoate
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > dicarboxylic acid anion > dicarboxylic acid monoanion > thiomalate(1-) > 3-carboxy-3-mercaptopropanoate
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > dicarboxylic acid anion > dicarboxylic acid monoanion > thiomalate(1-) > 3-carboxy-3-mercaptopropanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic anion > carboxylic acid anion > dicarboxylic acid anion > dicarboxylic acid monoanion > thiomalate(1-) > 3-carboxy-3-mercaptopropanoate

Preferred term

3-carboxy-3-mercaptopropanoate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • -1

formula

  • C4H5O4S

inchi

  • InChI=1S/C4H6O4S/c5-3(6)1-2(9)4(7)8/h2,9H,1H2,(H,5,6)(H,7,8)/p-1

inchikey

  • NJRXVEJTAYWCQJ-UHFFFAOYSA-M

is_tautomer_of

mass

  • 149.140

monoisotopicmass

  • 148.99140

smiles

  • OC(=O)C(S)CC([O-])=O

subset

  • 3_STAR

synonym EXACT

  • 3-carboxy-3-sulfanylpropanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:38707

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