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Concept information

... > organooxygen compound > ester > carboxylic ester > glyceride > triglyceride > tg(17:1(9z)/22:6(4z,7z,10z,13z,16z,19z)/22:6(4z,7z,10z,13z,16z,19z))[iso3]
... > organooxygen compound > carbonyl compound > carboxylic ester > glyceride > triglyceride > tg(17:1(9z)/22:6(4z,7z,10z,13z,16z,19z)/22:6(4z,7z,10z,13z,16z,19z))[iso3]
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > glyceride > triglyceride > tg(17:1(9z)/22:6(4z,7z,10z,13z,16z,19z)/22:6(4z,7z,10z,13z,16z,19z))[iso3]

Preferred term

tg(17:1(9z)/22:6(4z,7z,10z,13z,16z,19z)/22:6(4z,7z,10z,13z,16z,19z))[iso3]  

Type

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

Broader concept

charge

  • 0

formula

  • C64H98O6

inchi

  • InChI=1S/C64H98O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-39-42-45-48-51-54-57-63(66)69-60-61(59-68-62(65)56-53-50-47-44-41-38-27-24-21-18-15-12-9-6-3)70-64(67)58-55-52-49-46-43-40-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-17,19-20,24-29,32-35,39-40,42-43,48-49,51-52,61H,4-6,9,12-15,18,21-23,30-31,36-38,41,44-47,50,53-60H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,27-24-,28-25-,29-26-,34-32-,35-33-,42-39-,43-40-,51-48-,52-49-/t61-/m1/s1

inchikey

  • HPNLVDNBVGRVBK-ONWWWVMBSA-N

mass

  • 963.482

monoisotopicmass

  • 962.73634

smiles

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

subset

  • 2_STAR

synonym EXACT

  • [(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(Z)-heptadec-9-enoyl]oxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:196945

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