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Concept information

Preferred term

fr177391  

Type

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

charge

  • 0

formula

  • C23H31ClO8

inchi

  • InChI=1S/C23H31ClO8/c1-13(10-21(27)28)9-18(26)23-20-11-17(31-23)8-7-16(24)6-4-5-14(2)19(30-15(3)25)12-22(29)32-20/h5-6,9,17-20,23,26H,4,7-8,10-12H2,1-3H3,(H,27,28)/b13-9+,14-5-,16-6-/t17-,18-,19-,20-,23-/m1/s1

inchikey

  • OAWOFENLLWPBEQ-VXLXENEISA-N

mass

  • 470.94000

monoisotopicmass

  • 470.17075

smiles

  • [H][C@@]1(O[C@@H]2CC/C(Cl)=C/C/C=C(C)/[C@@H](CC(=O)O[C@@H]1C2)OC(C)=O)[C@H](O)/C=C(/C)CC(O)=O

subset

  • 3_STAR

synonym EXACT

  • (3E,5R)-5-[(1R,5R,6Z,9Z,13R,15R)-5-(acetyloxy)-10-chloro-6-methyl-3-oxo-2,14-dioxabicyclo[11.2.1]hexadeca-6,9-dien-15-yl]-5-hydroxy-3-methylpent-3-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65911

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