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Concept information

... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > flavans > hydroxyflavan > catechin > epicatechin-(6'->8)-epicatechin

Preferred term

epicatechin-(6'->8)-epicatechin  

Type

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

Broader concept

charge

  • 0

formula

  • C30H26O12

inchi

  • InChI=1S/C30H26O12/c31-12-4-18(33)15-8-25(40)29(41-26(15)5-12)14-7-22(37)21(36)6-13(14)27-23(38)10-19(34)16-9-24(39)28(42-30(16)27)11-1-2-17(32)20(35)3-11/h1-7,10,24-25,28-29,31-40H,8-9H2

inchikey

  • NFKUCWGVXFRSRX-UHFFFAOYSA-N

mass

  • 578.526

monoisotopicmass

  • 578.14243

smiles

  • O1C(C(O)CC2=C1C(C=3C(C4OC=5C(CC4O)=C(O)C=C(O)C5)=CC(O)=C(O)C3)=C(O)C=C2O)C6=CC(O)=C(O)C=C6

subset

  • 2_STAR

synonym EXACT

  • 2-(3,4-dihydroxyphenyl)-8-[4,5-dihydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)phenyl]-3,4-dihydro-2H-chromene-3,5,7-triol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173293

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