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Concept information

... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > flavonoid oligomer > biflavonoid > afzelechin-(4alpha->8)-afzelechin

Preferred term

afzelechin-(4alpha->8)-afzelechin  

Type

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

charge

  • 0

formula

  • C30H26O10

has_functional_parent

inchi

  • InChI=1S/C30H26O10/c31-15-5-1-13(2-6-15)28-22(37)11-18-19(34)12-21(36)25(30(18)40-28)26-24-20(35)9-17(33)10-23(24)39-29(27(26)38)14-3-7-16(32)8-4-14/h1-10,12,22,26-29,31-38H,11H2/t22-,26-,27-,28+,29+/m0/s1

inchikey

  • JESPWQGCCOLVKQ-AVFWISQGSA-N

mass

  • 546.52140

monoisotopicmass

  • 546.15260

smiles

  • O[C@H]1Cc2c(O)cc(O)c([C@H]3[C@H](O)[C@H](Oc4cc(O)cc(O)c34)c3ccc(O)cc3)c2O[C@@H]1c1ccc(O)cc1

subset

  • 3_STAR

synonym EXACT

  • (2R,2'R,3S,3'S,4S)-2,2'-bis(4-hydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-[4,8'-bi-1-benzopyran]-3,3',5,5',7,7'-hexol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:2508

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