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Concept information

Preferred term

sofalcone  

Type

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

charge

  • 0

formula

  • C27H30O6

inchi

  • InChI=1S/C27H30O6/c1-19(2)13-15-31-22-8-5-21(6-9-22)7-12-25(28)24-11-10-23(32-16-14-20(3)4)17-26(24)33-18-27(29)30/h5-14,17H,15-16,18H2,1-4H3,(H,29,30)/b12-7+

inchikey

  • GFWRVVCDTLRWPK-KPKJPENVSA-N

mass

  • 450.531

monoisotopicmass

  • 450.20424

smiles

  • CC(C)=CCOC1=CC=C(/C=C/C(=O)C2=C(OCC(O)=O)C=C(OCC=C(C)C)C=C2)C=C1

subset

  • 3_STAR

synonym EXACT

  • {5-[(3-methylbut-2-en-1-yl)oxy]-2-[(2E)-3-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}prop-2-enoyl]phenoxy}acetic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:135732

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