skip to main content

Chemistry, part 1

Content language

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

Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > salt > organic salt > organic halide salt > organic perchlorate salt > atto 590 > atto 590 para-isomer
... > organooxygen compound > carbonyl compound > carboxylic acid > dicarboxylic acid > atto 590 > atto 590 para-isomer
... > organooxygen compound > carbon oxoacid > carboxylic acid > dicarboxylic acid > atto 590 > atto 590 para-isomer
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > dicarboxylic acid > atto 590 > atto 590 para-isomer
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > dicarboxylic acid > atto 590 > atto 590 para-isomer
organic heterocyclic compound > organic heteropolycyclic compound > organic heteropentacyclic compound > atto 590 > atto 590 para-isomer

Preferred term

atto 590 para-isomer  

Type

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

Broader concept

charge

  • 0

formula

  • C36H37ClN2O9

has_part

has_role

inchi

  • InChI=1S/C36H36N2O5.ClHO4/c1-8-37-28-17-30-26(14-21(28)12-13-35(37,4)5)32(25-15-22(33(39)40)10-11-23(25)34(41)42)27-16-24-20(3)19-36(6,7)38(9-2)29(24)18-31(27)43-30;2-1(3,4)5/h10-19H,8-9H2,1-7H3,(H-,39,40,41,42);(H,2,3,4,5)

inchikey

  • JWFILYKQXSGKIU-UHFFFAOYSA-N

mass

  • 677.14000

monoisotopicmass

  • 676.21876

smiles

  • [O-]Cl(=O)(=O)=O.CCN1c2cc3Oc4cc5=[N+](CC)C(C)(C)C=Cc5cc4=C(c3cc2C(C)=CC1(C)C)c1cc(ccc1C(O)=O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 6-(2,5-dicarboxyphenyl)-1,11-diethyl-2,2,8,10,10-pentamethyl-10,11-dihydro-2H-pyrano[3,2-g:5,6-g']diquinolin-1-ium perchlorate

synonym RELATED

  • ATTO 590 free 2,5-dicarboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:51823

Download this concept:

RDF/XML TURTLE JSON-LD