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Concept information

organic aromatic compound > aromatic ether > vanillylmandelic acid
organic aromatic compound > phenols > vanillylmandelic acid

Preferred term

vanillylmandelic acid  

Type

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

charge

  • 0

formula

  • C9H10O5

has_functional_parent

inchi

  • InChI=1S/C9H10O5/c1-14-7-4-5(2-3-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)

inchikey

  • CGQCWMIAEPEHNQ-UHFFFAOYSA-N

is_conjugate_acid_of

mass

  • 198.17270

monoisotopicmass

  • 198.05282

smiles

  • COc1cc(ccc1O)C(O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetic acid
  • Vanillylmandelic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:20106

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