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Chemistry, part 1

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Concept information

... > 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 > aryl sulfate > 2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > sulfates > organic sulfate > aryl sulfate > 2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid
... > 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 > aryl sulfate > 2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > organic sulfate > aryl sulfate > 2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid
organooxygen compound > ester > sulfuric ester > aryl sulfate > 2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid
... > 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 > aryl sulfate > 2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfuric acid derivative > sulfuric ester > aryl sulfate > 2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid

Preferred term

2,3-dihydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C14H18O8S

inchi

  • InChI=1S/C14H18O8S/c1-8(2)3-4-9-7-10(12(15)13(16)14(17)18)5-6-11(9)22-23(19,20)21/h3,5-7,12-13,15-16H,4H2,1-2H3,(H,17,18)(H,19,20,21)

inchikey

  • YMXCSOFQJSOFRQ-UHFFFAOYSA-N

mass

  • 346.350

monoisotopicmass

  • 346.07224

smiles

  • S(OC1=C(C=C(C(O)C(O)C(O)=O)C=C1)CC=C(C)C)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • 2,3-dihydroxy-3-[3-(3-methylbut-2-enyl)-4-sulooxyphenyl]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:187136

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