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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > carbonate ester > phomoxin
organooxygen compound > carbonyl compound > carboxylic ester > carbonate ester > phomoxin
organooxygen compound > carbonates > carbonate ester > phomoxin

Preferred term

phomoxin  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O6

inchi

  • InChI=1S/C15H22O6/c1-2-3-4-5-6-7-9-10(8-16)11(17)12(18)14-13(9)20-15(19)21-14/h6-7,11-14,16-18H,2-5,8H2,1H3/b7-6+/t11-,12-,13-,14+/m0/s1

inchikey

  • ZDKCZSBZBVIVCB-BALZYMCLSA-N

mass

  • 298.335

monoisotopicmass

  • 298.14164

smiles

  • O=C1O[C@H]2C(=C(CO)[C@@H]([C@@H]([C@H]2O1)O)O)/C=C/CCCCC

subset

  • 2_STAR

synonym EXACT

  • (3aR,4S,5S,7aS)-7-[(E)-hept-1-enyl]-4,5-dihydroxy-6-(hydroxymethyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxol-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216535

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