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Concept information

Preferred term

3,4,5-trihydroxy-6-/{[(4e)-5-(4-methoxyphenyl)-3-oxopent-4-en-1-yl]oxy/}oxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C18H22O9

inchi

  • InChI=1S/C18H22O9/c1-25-12-6-3-10(4-7-12)2-5-11(19)8-9-26-18-15(22)13(20)14(21)16(27-18)17(23)24/h2-7,13-16,18,20-22H,8-9H2,1H3,(H,23,24)/b5-2+

inchikey

  • ZLTQWAYJMINEQV-GORDUTHDSA-N

mass

  • 382.365

monoisotopicmass

  • 382.12638

smiles

  • O1C(OCCC(=O)/C=C/C2=CC=C(OC)C=C2)C(O)C(O)C(O)C1C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 3,4,5-trihydroxy-6-[(E)-5-(4-methoxyphenyl)-3-oxopent-4-enoxy]oxane-2-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190862

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