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Concept information

Preferred term

8 [(1S,2S) 3 oxo 2 /{(Z) pent 2 en 1 yl/}cyclopentyl]octanoate  

Type

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

charge

  • -1

formula

  • C18H29O3

has_functional_parent

inchi

  • InChI=1S/C18H30O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,15-16H,2,4-6,8-14H2,1H3,(H,20,21)/p-1/b7-3-/t15-,16-/m0/s1

inchikey

  • BZXZFDKIRZBJEP-JMTMCXQRSA-M

mass

  • 293.428

monoisotopicmass

  • 293.21222

smiles

  • CC/C=C/C[C@H]1[C@@H](CCCCCCCC([O-])=O)CCC1=O

subset

  • 3_STAR

synonym EXACT

  • 8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191855

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