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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 > clavulone > clavulolactone iii

Preferred term

clavulolactone iii  

Type

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

Broader concept

charge

  • 0

formula

  • C22H28O5

inchi

  • InChI=1S/C22H28O5/c1-3-4-5-6-7-8-15-22(27-17(2)23)16-14-20(24)19(22)11-9-10-18-12-13-21(25)26-18/h7-11,14,16,18H,3-6,12-13,15H2,1-2H3/b8-7-,10-9+,19-11+/t18-,22-/m0/s1

inchikey

  • HSBZTFDKHKMFDC-PLWPPGCESA-N

mass

  • 372.461

monoisotopicmass

  • 372.19367

smiles

  • O([C@]1(C/C=C/CCCCC)/C(/C(=O)C=C1)=C/C=C/[C@@H]2OC(=O)CC2)C(=O)C

subset

  • 2_STAR

synonym EXACT

  • [(1S,5Z)-1-[(Z)-oct-2-enyl]-4-oxo-5-[(E)-3-[(2R)-5-oxooxolan-2-yl]prop-2-enylidene]cyclopent-2-en-1-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197144

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