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Concept information

Preferred term

TG(18:1(9Z)/14:0/18:2(9Z،12Z))[iso6]  

Type

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

Broader concept

charge

  • 0

formula

  • C53H96O6

inchi

  • InChI=1S/C53H96O6/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-45-51(54)57-48-50(59-53(56)47-44-41-38-35-30-21-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h16,19,24-27,50H,4-15,17-18,20-23,28-49H2,1-3H3/b19-16-,26-24-,27-25-/t50-/m0/s1

inchikey

  • WBZBEPPZYAUHCV-OUCITFGBSA-N

mass

  • 829.328

monoisotopicmass

  • 828.72069

smiles

  • C([C@@](COC(CCCCCCC/C=C/CCCCCCCC)=O)(OC(CCCCCCCCCCCCC)=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:88982

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