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 > organosulfur compound > organosulfonic acid > arenesulfonic acid > naphthalenesulfonic acid > azorubine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > sulfur oxoacid derivative > sulfonic acid derivative > organosulfonic acid > arenesulfonic acid > naphthalenesulfonic acid > azorubine
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfonic acid derivative > organosulfonic acid > arenesulfonic acid > naphthalenesulfonic acid > azorubine

Preferred term

azorubine  

Type

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

Broader concept

charge

  • 0

formula

  • C20H14N2O7S2

inchi

  • InChI=1S/C20H14N2O7S2/c23-20-15-8-4-3-7-14(15)19(31(27,28)29)11-17(20)22-21-16-9-10-18(30(24,25)26)13-6-2-1-5-12(13)16/h1-11,23H,(H,24,25,26)(H,27,28,29)/b22-21+

inchikey

  • TVWOWDDBXAFQDG-QURGRASLSA-N

mass

  • 458.460

monoisotopicmass

  • 458.02424

smiles

  • S(O)(=O)(=O)C=1C=2C(C(O)=C(/N=N/C=3C=4C(C(S(O)(=O)=O)=CC3)=CC=CC4)C1)=CC=CC2

subset

  • 2_STAR

synonym EXACT

  • 4-hydroxy-3-[(4-sulonaphthalen-1-yl)diazenyl]naphthalene-1-sulonic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:180754

Download this concept:

RDF/XML TURTLE JSON-LD