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Concept information

Preferred term

trihomononactic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C13H24O4

inchi

  • InChI=1S/C13H24O4/c1-4-5-10(14)8(2)11-6-7-12(17-11)9(3)13(15)16/h8-12,14H,4-7H2,1-3H3,(H,15,16)/t8-,9-,10-,11-,12+/m0/s1

inchikey

  • PHBJNSWUIXMFPC-UHFZAUJKSA-N

mass

  • 244.331

monoisotopicmass

  • 244.16746

smiles

  • O=C(O)[C@H]([C@@H]1O[C@H]([C@H]([C@@H](O)CCC)C)CC1)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[(2R,5S)-5-[(2S,3S)-3-hydroxyhexan-2-yl]oxolan-2-yl]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225006

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