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Concept information

Preferred term

ps(21:0/20:3(8z,11z,14z))  

Type

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

Broader concept

charge

  • 0

formula

  • C47H86NO10P

inchi

  • InChI=1S/C47H86NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-45(49)55-40-43(41-56-59(53,54)57-42-44(48)47(51)52)58-46(50)39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,25,27,43-44H,3-11,13,15-17,19,21-24,26,28-42,48H2,1-2H3,(H,51,52)(H,53,54)/b14-12-,20-18-,27-25-/t43-,44+/m1/s1

inchikey

  • ZVCHLEVHFZLUBI-RXZGSDMMSA-N

mass

  • 856.176

monoisotopicmass

  • 855.59893

smiles

  • P(OC[C@H](OC(=O)CCCCCC/C=C/C/C=C/C/C=C/CCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCC)(OC[C@H](N)C(O)=O)(O)=O

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-amino-3-[[(2R)-3-henicosanoyloxy-2-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:196432

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