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Concept information

Preferred term

pe-nme2(18:3(9z,12z,15z)/20:3(5z,8z,11z))  

Type

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

Broader concept

charge

  • 0

formula

  • C45H78NO8P

inchi

  • InChI=1S/C45H78NO8P/c1-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-45(48)54-43(42-53-55(49,50)52-40-39-46(3)4)41-51-44(47)37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-2/h8,10,14,16,19-21,23-24,26,30,32,43H,5-7,9,11-13,15,17-18,22,25,27-29,31,33-42H2,1-4H3,(H,49,50)/b10-8-,16-14-,21-19-,23-20-,26-24-,32-30-

inchikey

  • YHWHUBCVOGBOJA-OWZWJWHISA-N

mass

  • 792.092

monoisotopicmass

  • 791.54651

smiles

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

subset

  • 2_STAR

synonym EXACT

  • [1-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropan-2-yl] (5Z,8Z,11Z)-icosa-5,8,11-trienoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:171125

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