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Concept information

Preferred term

tg(18:1(11z)/16:0/18:2(9z,12z))[iso3]  

Type

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

Broader concept

charge

  • 0

formula

  • C55H100O6

inchi

  • InChI=1S/C55H100O6/c1-4-7-10-13-16-19-22-25-27-30-32-35-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-37-34-29-24-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h16,19-20,23,25,27,52H,4-15,17-18,21-22,24,26,28-51H2,1-3H3/b19-16-,23-20-,27-25-/t52-/m0/s1

inchikey

  • CKVYPEYQBVKVNX-XFAWJRLMSA-N

mass

  • 857.381

monoisotopicmass

  • 856.75199

smiles

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

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:89011

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