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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > phthalate ester > talarolactone a
organooxygen compound > carbonyl compound > carboxylic ester > phthalate ester > talarolactone a

Preferred term

talarolactone a  

Type

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

Broader concept

charge

  • 0

formula

  • C13H12O5S

inchi

  • InChI=1S/C13H12O5S/c1-5-7-4-19-11-6(12(14)15)3-8(17-2)10(9(7)11)13(16)18-5/h3,5,7H,4H2,1-2H3,(H,14,15)/t5-,7-/m0/s1

inchikey

  • VJIDDYWMOLKPQK-FSPLSTOPSA-N

mass

  • 280.290

monoisotopicmass

  • 280.04054

smiles

  • S1C2=C(C(=O)O)C=C(OC)C3=C2[C@@H](C1)[C@@H](OC3=O)C

subset

  • 2_STAR

synonym EXACT

  • (4R,5S)-9-methoxy-5-methyl-7-oxo-6-oxa-2-thiatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-11-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:226240

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