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Concept information

Preferred term

PA (13:0/PGF2alpha)  

Type

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

Broader concept

charge

  • 0

formula

  • C36H65O11P

inchi

  • InChI=1S/C36H65O11P/c1-3-5-7-8-9-10-11-12-13-18-22-35(40)45-27-30(28-46-48(42,43)44)47-36(41)23-19-15-14-17-21-31-32(34(39)26-33(31)38)25-24-29(37)20-16-6-4-2/h14,17,24-25,29-34,37-39H,3-13,15-16,18-23,26-28H2,1-2H3,(H2,42,43,44)/b17-14+,25-24+/t29-,30+,31+,32+,33-,34+/m0/s1

inchikey

  • KMSORYPCXSFFQB-YENUPOCKSA-N

mass

  • 704.879

monoisotopicmass

  • 704.42645

smiles

  • P(OC[C@H](OC(=O)CCC/C=C/C[C@@H]1[C@H]([C@H](O)C[C@@H]1O)/C=C/[C@@H](O)CCCCC)COC(=O)CCCCCCCCCCCC)(O)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [(2R)-2-[(E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoyl]oxy-3-phosphonooxypropyl] tridecanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230765

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