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Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > schembl9567921
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfuric acid derivative > sulfates > organic sulfate > alkyl sulfate > schembl9567921
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > sulfates > organic sulfate > alkyl sulfate > schembl9567921
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfuric acid derivative > organic sulfate > alkyl sulfate > schembl9567921
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > organic sulfate > alkyl sulfate > schembl9567921
organooxygen compound > ester > sulfuric ester > alkyl sulfate > schembl9567921
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfuric acid derivative > sulfuric ester > alkyl sulfate > schembl9567921
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > sulfuric ester > alkyl sulfate > schembl9567921

Preferred term

schembl9567921  

Type

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

Broader concept

charge

  • 0

formula

  • C4H6O8S

inchi

  • InChI=1S/C4H6O8S/c5-3(6)1-2(4(7)8)12-13(9,10)11/h2H,1H2,(H,5,6)(H,7,8)(H,9,10,11)

inchikey

  • NEDXTJCJRKUSGT-UHFFFAOYSA-N

mass

  • 214.140

monoisotopicmass

  • 213.97834

smiles

  • S(OC(CC(O)=O)C(O)=O)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • 2-sulooxybutanedioic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185515

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