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Concept information

Preferred term

pe-nme2(16:1(9z)/22:5(7z,10z,13z,16z,19z))  

Type

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

Broader concept

charge

  • 0

formula

  • C45H78NO8P

inchi

  • InChI=1S/C45H78NO8P/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-45(48)54-43(42-53-55(49,50)52-40-39-46(3)4)41-51-44(47)37-35-33-31-29-27-25-18-16-14-12-10-8-6-2/h7,9,13,15-16,18-20,22-23,26,28,43H,5-6,8,10-12,14,17,21,24-25,27,29-42H2,1-4H3,(H,49,50)/b9-7-,15-13-,18-16-,20-19-,23-22-,28-26-

inchikey

  • YNHQGGKVRHVDGB-PLQHXMPSSA-N

mass

  • 792.092

monoisotopicmass

  • 791.54651

smiles

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

subset

  • 2_STAR

synonym EXACT

  • [1-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-3-[(Z)-hexadec-9-enoyl]oxypropan-2-yl] (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:171118

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