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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 > pc(pgf1alpha/24:1(15z))

Preferred term

pc(pgf1alpha/24:1(15z))  

Type

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

Broader concept

charge

  • 0

formula

  • C52H98NO11P

inchi

  • InChI=1S/C52H98NO11P/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-33-37-52(58)64-46(44-63-65(59,60)62-41-40-53(3,4)5)43-61-51(57)36-32-29-28-31-35-47-48(50(56)42-49(47)55)39-38-45(54)34-30-9-7-2/h15-16,38-39,45-50,54-56H,6-14,17-37,40-44H2,1-5H3/b16-15-,39-38+/t45-,46+,47+,48+,49-,50+/m0/s1

inchikey

  • QZYKRRSVPOZCBC-CJITYVHBSA-N

mass

  • 944.326

monoisotopicmass

  • 943.68775

smiles

  • P(OC[C@H](OC(=O)CCCCCCCCCCCCC/C=C/CCCCCCCC)COC(=O)CCCCCC[C@@H]1[C@H]([C@H](O)C[C@@H]1O)/C=C/[C@@H](O)CCCCC)(OCC[N+](C)(C)C)([O-])=O

subset

  • 2_STAR

synonym EXACT

  • [(2R)-3-[7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]heptanoyloxy]-2-[(Z)-tetracos-15-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:231143

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