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Concept information

Preferred term

pe-nme2(20:3(5z,8z,11z)/18:2(9z,12z))  

Type

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

Broader concept

charge

  • 0

formula

  • C45H80NO8P

inchi

  • InChI=1S/C45H80NO8P/c1-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46(3)4)54-45(48)38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-2/h14,16,19-21,23-25,29,31,43H,5-13,15,17-18,22,26-28,30,32-42H2,1-4H3,(H,49,50)/b16-14-,21-19-,23-20-,25-24-,31-29-

inchikey

  • MKYBIWPWEUZVRA-VRACOPBCSA-N

mass

  • 794.108

monoisotopicmass

  • 793.56216

smiles

  • P(OCC(OC(=O)CCCCCCC/C=C/C/C=C/CCCCC)COC(=O)CCC/C=C/C/C=C/C/C=C/CCCCCCCC)(OCCN(C)C)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] (5Z,8Z,11Z)-icosa-5,8,11-trienoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:171258

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