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Concept information

Preferred term

tg(18:1(9z)/18:0/18:3(9z,12z,15z))[iso6]  

Type

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

Broader concept

charge

  • 0

formula

  • C57H102O6

inchi

  • InChI=1S/C57H102O6/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/h7,10,16,19,25-26,28-29,54H,4-6,8-9,11-15,17-18,20-24,27,30-53H2,1-3H3/b10-7-,19-16-,28-25-,29-26-/t54-/m0/s1

inchikey

  • AJZXAAFSXUMAJT-PGKAUNPKSA-N

mass

  • 883.418

monoisotopicmass

  • 882.76764

smiles

  • C([C@@](COC(CCCCCCC/C=C/CCCCCCCC)=O)(OC(CCCCCCCCCCCCCCCCC)=O)[H])OC(CCCCCCC/C=C/C/C=C/C/C=C/CC)=O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:88971

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