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Concept information

Preferred term

2 O sinapoyl D گلوکاریک اسید  

Type

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

charge

  • 0

formula

  • C17H20O12

inchi

  • InChI=1S/C17H20O12/c1-27-8-5-7(6-9(28-2)11(8)19)3-4-10(18)29-15(17(25)26)13(21)12(20)14(22)16(23)24/h3-6,12-15,19-22H,1-2H3,(H,23,24)(H,25,26)/b4-3+/t12-,13-,14-,15+/m0/s1

inchikey

  • XQQYFEOTBHJJDK-GRRSETRSSA-N

mass

  • 416.33350

monoisotopicmass

  • 416.09548

smiles

  • COc1cc(cc(OC)c1O)/C=C/C(=O)O[C@H]([C@@H](O)[C@H](O)[C@H](O)C(O)=O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • 2-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-D-glucaric acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:49198

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