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Concept information

Preferred term

متا ایزومر ATTO 590 (1+)  

Type

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

charge

  • +1

formula

  • C37H39N2O5

inchi

  • InChI=1S/C37H38N2O5/c1-9-38-29-16-31-27(14-24(29)20(3)18-36(38,5)6)33(23-12-11-22(34(40)41)13-26(23)35(42)43)28-15-25-21(4)19-37(7,8)39(10-2)30(25)17-32(28)44-31/h11-19H,9-10H2,1-8H3,(H-,40,41,42,43)/p+1

inchikey

  • USDJZBOGKDODDO-UHFFFAOYSA-O

mass

  • 591.71600

monoisotopicmass

  • 591.28535

smiles

  • CCN1c2cc3Oc4cc5=[N+](CC)C(C)(C)C=C(C)c5cc4=C(c3cc2C(C)=CC1(C)C)c1ccc(cc1C(O)=O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 6-(2,4-dicarboxyphenyl)-1,11-diethyl-2,2,4,8,10,10-hexamethyl-10,11-dihydro-2H-pyrano[3,2-g:5,6-g']diquinolin-1-ium

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:52799

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