skip to main content

Content language

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

Concept information

organooxygen compound > oxacycle > benzodioxoles > [1-(6,7-dimethoxy-2h-1,3-benzodioxol-5-yl)-3-oxopropoxy]sulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxoles > [1-(6,7-dimethoxy-2h-1,3-benzodioxol-5-yl)-3-oxopropoxy]sulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxoles > [1-(6,7-dimethoxy-2h-1,3-benzodioxol-5-yl)-3-oxopropoxy]sulfonic acid

Preferred term

[1-(6,7-dimethoxy-2h-1,3-benzodioxol-5-yl)-3-oxopropoxy]sulfonic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C12H14O9S

inchi

  • InChI=1S/C12H14O9S/c1-17-10-7(8(3-4-13)21-22(14,15)16)5-9-11(12(10)18-2)20-6-19-9/h4-5,8H,3,6H2,1-2H3,(H,14,15,16)

inchikey

  • YABJOGBGPONFRJ-UHFFFAOYSA-N

mass

  • 334.300

monoisotopicmass

  • 334.03585

smiles

  • S(OC(C=1C(OC)=C(OC)C=2OCOC2C1)CC=O)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • [1-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-3-oxopropyl] hydrogen sulate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184512

Download this concept: