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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > icosanoid > prostanoid > pa(a-25:0/pge1)

Preferred term

pa(a-25:0/pge1)  

Type

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

Broader concept

charge

  • 0

formula

  • C48H89O11P

inchi

  • InChI=1S/C48H89O11P/c1-4-6-25-31-41(49)35-36-44-43(45(50)37-46(44)51)32-27-23-24-29-34-48(53)59-42(39-58-60(54,55)56)38-57-47(52)33-28-22-20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-26-30-40(3)5-2/h35-36,40-44,46,49,51H,4-34,37-39H2,1-3H3,(H2,54,55,56)/b36-35+/t40?,41-,42+,43+,44+,46+/m0/s1

inchikey

  • AYNPJPZXKAVQAL-GQJXXSKJSA-N

mass

  • 873.203

monoisotopicmass

  • 872.61425

smiles

  • P(OC[C@H](OC(=O)CCCCCC[C@@H]1[C@H]([C@H](O)CC1=O)/C=C/[C@@H](O)CCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCC(CC)C)(O)(O)=O

subset

  • 2_STAR

synonym EXACT

  • [(2R)-2-[7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoyloxy]-3-phosphonooxypropyl] 22-methyltetracosanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:231041

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