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Concept information

... > organooxygen compound > ester > carboxylic ester > glyceride > diglyceride > 1,3-diglyceride > (2r)-2-hydroxy-3-[(9z,12z)-nonadeca-9,12-dienoyloxy]propyl (13z)-docos-13-enoate
... > organooxygen compound > carbonyl compound > carboxylic ester > glyceride > diglyceride > 1,3-diglyceride > (2r)-2-hydroxy-3-[(9z,12z)-nonadeca-9,12-dienoyloxy]propyl (13z)-docos-13-enoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > glyceride > diglyceride > 1,3-diglyceride > (2r)-2-hydroxy-3-[(9z,12z)-nonadeca-9,12-dienoyloxy]propyl (13z)-docos-13-enoate

Preferred term

(2r)-2-hydroxy-3-[(9z,12z)-nonadeca-9,12-dienoyloxy]propyl (13z)-docos-13-enoate  

Type

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

Broader concept

charge

  • 0

formula

  • C44H80O5

inchi

  • InChI=1S/C44H80O5/c1-3-5-7-9-11-13-15-17-19-21-22-23-25-27-29-31-33-35-37-39-44(47)49-41-42(45)40-48-43(46)38-36-34-32-30-28-26-24-20-18-16-14-12-10-8-6-4-2/h14,16-17,19-20,24,42,45H,3-13,15,18,21-23,25-41H2,1-2H3/b16-14-,19-17-,24-20-/t42-/m0/s1

inchikey

  • ZRHLLYXUUATGHJ-NNYYJZEZSA-N

mass

  • 689.119

monoisotopicmass

  • 688.60058

smiles

  • O(C(=O)CCCCCCCCCCC/C=C/CCCCCCCC)C[C@@H](O)COC(=O)CCCCCCC/C=C/C/C=C/CCCCCC

subset

  • 2_STAR

synonym EXACT

  • [(2R)-2-hydroxy-3-[(9Z,12Z)-nonadeca-9,12-dienoyl]oxypropyl] (Z)-docos-13-enoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184811

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