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Concept information

Preferred term

16,16-dimethylprostaglandin e2  

Type

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

charge

  • 0

formula

  • C22H36O5

has_role

inchi

  • InChI=1S/C22H36O5/c1-4-5-14-22(2,3)20(25)13-12-17-16(18(23)15-19(17)24)10-8-6-7-9-11-21(26)27/h6,8,12-13,16-17,19-20,24-25H,4-5,7,9-11,14-15H2,1-3H3,(H,26,27)/b8-6-,13-12+/t16-,17-,19-,20-/m1/s1

inchikey

  • QAOBBBBDJSWHMU-WMBBNPMCSA-N

mass

  • 380.519

monoisotopicmass

  • 380.25627

smiles

  • C(/[C@H]1[C@@H](CC([C@@H]1C/C=C/CCCC(O)=O)=O)O)=C/[C@H](C(CCCC)(C)C)O

subset

  • 3_STAR

synonym EXACT

  • (5Z,11alpha,13E,15R)-11,15-dihydroxy-16,16-dimethyl-9-oxoprosta-5,13-dien-1-oic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:141046

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