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Concept information

Preferred term

(9s,10e,12z,14e,16s)-9,16-bis(hydroperoxy)octadecatrienoate  

Type

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

charge

  • -1

formula

  • C18H29O6

inchi

  • InChI=1S/C18H30O6/c1-2-16(23-21)12-8-6-7-10-14-17(24-22)13-9-4-3-5-11-15-18(19)20/h6-8,10,12,14,16-17,21-22H,2-5,9,11,13,15H2,1H3,(H,19,20)/p-1/b7-6-,12-8+,14-10+/t16-,17-/m0/s1

inchikey

  • MFVHQYMRUDEPIO-NYOLHIHQSA-M

mass

  • 341.420

monoisotopicmass

  • 341.19696

smiles

  • C(CCCCCCC[C@@H](/C=C/C=C/C=C/[C@H](CC)OO)OO)([O-])=O

subset

  • 3_STAR

synonym EXACT

  • (9S,10E,12Z,14E,16S)-9,16-bis(hydroperoxy)octadeca-10,12,14-trienoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:133991

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