skip to main content

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 > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfuric acid derivative > sulfates > organic sulfate > aryl sulfate > 2-hydroxy-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-hydroxy-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-hydroxy-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-hydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid
organooxygen compound > ester > sulfuric ester > aryl sulfate > 2-hydroxy-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-hydroxy-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-hydroxy-3-[3-(3-methylbut-2-en-1-yl)-4-(sulfooxy)phenyl]propanoic acid

Preferred term

2-hydroxy-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

  • C14H18O7S

inchi

  • InChI=1S/C14H18O7S/c1-9(2)3-5-11-7-10(8-12(15)14(16)17)4-6-13(11)21-22(18,19)20/h3-4,6-7,12,15H,5,8H2,1-2H3,(H,16,17)(H,18,19,20)

inchikey

  • BJWLMQFXRQNZLN-UHFFFAOYSA-N

mass

  • 330.350

monoisotopicmass

  • 330.07732

smiles

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

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229875

Download this concept:

RDF/XML TURTLE JSON-LD