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 > carbon group molecular entity > organic molecular entity > 2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > dipolar compound > zwitterion > amino-acid zwitterion > 2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > dipolar compound > zwitterion > amino-acid zwitterion > 2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion

Preferred term

2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion  

Type

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

Broader concept

charge

  • 0

formula

  • C6H6ClNO3

inchi

  • InChI=1S/C6H6ClNO3/c7-4(3-9)1-2-5(8)6(10)11/h1-3H,8H2,(H,10,11)/b4-1+,5-2+

inchikey

  • YEIFVAPTZWXPNE-GRSRPBPQSA-N

is_tautomer_of

mass

  • 175.57000

monoisotopicmass

  • 175.00362

smiles

  • [H]C(=O)C(/Cl)=C/C=C(/[NH3+])C([O-])=O

subset

  • 3_STAR

synonym RELATED

  • 2-amino-5-chloromuconate 6-semialdehyde
  • (2E,4E)-2-azaniumyl-5-chloro-6-oxohexa-2,4-dienoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:75057

Download this concept:

RDF/XML TURTLE JSON-LD