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Concept information

Preferred term

PI (16:0/16:2 (9ZZ،12Z))  

Type

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

charge

  • 0

formula

  • C41H75O13P

inchi

  • InChI=1S/C41H75O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)51-31-33(32-52-55(49,50)54-41-39(47)37(45)36(44)38(46)40(41)48)53-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h8,10,14,16,33,36-41,44-48H,3-7,9,11-13,15,17-32H2,1-2H3,(H,49,50)/b10-8-,16-14-/t33-,36-,37-,38+,39-,40-,41-/m1/s1

inchikey

  • XVAYDAQDXIWIQD-VCZPOYPHSA-N

mass

  • 807.002

monoisotopicmass

  • 806.49453

smiles

  • [C@@H]1([C@@H]([C@@H]([C@@H]([C@H]([C@@H]1O)O)O)O)OP(OC[C@@H](COC(CCCCCCCCCCCCCCC)=O)OC(CCCCCCC/C=C/C/C=C/CCC)=O)(=O)O)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:137331

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