skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

TG(18:2(9Z,12Z)/14:0/18:2(9Z,12Z))[iso3]  

Type

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

Broader concept

charge

  • 0

formula

  • C53H94O6

inchi

  • InChI=1S/C53H94O6/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/h16-17,19-20,24-27,50H,4-15,18,21-23,28-49H2,1-3H3/b19-16-,20-17-,26-24-,27-25-

inchikey

  • JZVVUGYNBNZRQI-ZBTSZJFVSA-N

mass

  • 827.312

monoisotopicmass

  • 826.70504

smiles

  • C([C@@](COC(CCCCCCC/C=C/C/C=C/CCCCC)=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:88890

Download this concept: