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Concept information

Preferred term

pe-nme2(22:5(4z,7z,10z,13z,16z)/16:1(9z))  

Type

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

Broader concept

charge

  • 0

formula

  • C45H78NO8P

inchi

  • InChI=1S/C45H78NO8P/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-26-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46(3)4)54-45(48)38-36-34-32-30-28-25-18-16-14-12-10-8-6-2/h13,15-16,18-20,22-23,26-27,31,33,43H,5-12,14,17,21,24-25,28-30,32,34-42H2,1-4H3,(H,49,50)/b15-13-,18-16-,20-19-,23-22-,27-26-,33-31-

inchikey

  • SHSWUSMGTIERMO-GIPNEVIVSA-N

mass

  • 792.092

monoisotopicmass

  • 791.54651

smiles

  • P(OCC(OC(=O)CCCCCCC/C=C/CCCCCC)COC(=O)CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C/CCCCC)(OCCN(C)C)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(Z)-hexadec-9-enoyl]oxypropyl] (4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:171122

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