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Concept information

Preferred term

tg(18:2(9z,12z)/18:1(11z)/18:2(9z,12z))[iso3]  

Type

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

Broader concept

charge

  • 0

formula

  • C57H100O6

inchi

  • InChI=1S/C57H100O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-17,19-21,24-26,28-29,54H,4-15,18,22-23,27,30-53H2,1-3H3/b19-16-,20-17-,24-21-,28-25-,29-26-

inchikey

  • YJBUODNAHDVYLJ-LNZLXKATSA-N

mass

  • 881.402

monoisotopicmass

  • 880.75199

smiles

  • C([C@@](COC(CCCCCCC/C=C/C/C=C/CCCCC)=O)(OC(CCCCCCCCC/C=C/CCCCCC)=O)[H])OC(CCCCCCC/C=C/C/C=C/CCCCC)=O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:88899

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