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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 > leukotriene > pg(a-25:0/lte4)

Preferred term

pg(a-25:0/lte4)  

Type

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

Broader concept

charge

  • 0

formula

  • C54H98NO13PS

inchi

  • InChI=1S/C54H98NO13PS/c1-4-6-7-8-9-10-11-21-24-27-30-33-38-51(50(58)37-35-39-52(59)60)70-45-49(55)54(62)68-48(44-67-69(63,64)66-42-47(57)41-56)43-65-53(61)40-34-31-28-25-22-19-17-15-13-12-14-16-18-20-23-26-29-32-36-46(3)5-2/h9-10,21,24,27,30,33,38,46-51,56-58H,4-8,11-20,22-23,25-26,28-29,31-32,34-37,39-45,55H2,1-3H3,(H,59,60)(H,63,64)/b10-9-,24-21-,30-27+,38-33+/t46?,47-,48+,49-,50-,51+/m0/s1

inchikey

  • YNRHUGPKSWILDF-XPUXNRHLSA-N

mass

  • 1032.410

monoisotopicmass

  • 1031.64965

smiles

  • S([C@@H]([C@@H](O)CCCC(O)=O)/C=C/C=C/C=C/C/C=C/CCCCC)C[C@H](N)C(O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC(CC)C)COP(OC[C@@H](O)CO)(O)=O)=O

subset

  • 2_STAR

synonym EXACT

  • (5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-amino-3-[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-(22-methyltetracosanoyloxy)propan-2-yl]oxy-3-oxopropyl]sulanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:231126

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