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Concept information

organooxygen compound > ether > purpurester a

Preferred term

purpurester a  

Type

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

charge

  • 0

formula

  • C13H16O5

inchi

  • InChI=1S/C13H16O5/c1-4-5-13(17-3)8-6-9(14)11(15)7(2)10(8)12(16)18-13/h6,14-15H,4-5H2,1-3H3/t13-/m0/s1

inchikey

  • CHYNVNQRYJSKBG-ZDUSSCGKSA-N

mass

  • 252.26310

monoisotopicmass

  • 252.09977

smiles

  • CCC[C@]1(OC)OC(=O)c2c1cc(O)c(O)c2C

subset

  • 3_STAR

synonym EXACT

  • (3S)-5,6-dihydroxy-3-methoxy-7-methyl-3-propyl-2-benzofuran-1(3H)-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69472

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