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Concept information

Preferred term

TG(16:1(9Z)/16:0/18:1(11Z))[iso6]  

Type

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

Broader concept

charge

  • 0

formula

  • C53H98O6

inchi

  • InChI=1S/C53H98O6/c1-4-7-10-13-16-19-22-25-26-29-31-34-37-40-43-46-52(55)58-49-50(59-53(56)47-44-41-38-35-32-28-24-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2/h19-20,22-23,50H,4-18,21,24-49H2,1-3H3/b22-19-,23-20-/t50-/m1/s1

inchikey

  • TVENQJOAVIJNCV-WMKGZJNJSA-N

mass

  • 831.344

monoisotopicmass

  • 830.73634

smiles

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

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:89019

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