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Concept information

... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > flavans > hydroxyflavan > catechin > catechin 5,7,4'-trimethyl ether

Preferred term

catechin 5,7,4'-trimethyl ether  

Type

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

Broader concept

charge

  • 0

formula

  • C18H20O6

inchi

  • InChI=1S/C18H20O6/c1-21-11-7-16(23-3)12-9-14(20)18(24-17(12)8-11)10-4-5-15(22-2)13(19)6-10/h4-8,14,18-20H,9H2,1-3H3/t14-,18+/m0/s1

inchikey

  • WCBCDLSKTYUDDL-KBXCAEBGSA-N

mass

  • 332.352

monoisotopicmass

  • 332.12599

smiles

  • O1[C@@H]([C@@H](O)CC2=C1C=C(OC)C=C2OC)C3=CC(O)=C(OC)C=C3

subset

  • 2_STAR

synonym EXACT

  • (2R,3S)-2-(3-hydroxy-4-methoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-chromen-3-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:193310

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