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Concept information

... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > flavonoid oligomer > proanthocyanidin > epigallocatechin-(4beta->8,2beta->o-7)-epicatechin

Preferred term

epigallocatechin-(4beta->8,2beta->o-7)-epicatechin  

Type

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

Broader concept

charge

  • 0

formula

  • C30H24O13

has_functional_parent

has_role

inchi

  • InChI=1S/C30H24O13/c31-12-6-17(35)23-21(7-12)42-30(11-4-18(36)26(39)19(37)5-11)29(40)25(23)24-22(43-30)9-15(33)13-8-20(38)27(41-28(13)24)10-1-2-14(32)16(34)3-10/h1-7,9,20,25,27,29,31-40H,8H2/t20-,25-,27-,29-,30+/m1/s1

inchikey

  • WODBGULXKVZGQF-QCPBNORNSA-N

mass

  • 592.50380

monoisotopicmass

  • 592.12169

smiles

  • [H][C@@]1(Oc2c(C[C@H]1O)c(O)cc1O[C@@]3(Oc4cc(O)cc(O)c4[C@@]([H])([C@H]3O)c21)c1cc(O)c(O)c(O)c1)c1ccc(O)c(O)c1

subset

  • 3_STAR

synonym EXACT

  • (2R,3R,8S,14R,15R)-2-(3,4-dihydroxyphenyl)-8-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H,14H-8,14-methanochromeno[7,8-d][1,3]benzodioxocine-3,5,11,13,15-pentol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65854

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