skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxyflavan > catechin > 9,10-dihydro-10-(4-hydroxyphenyl)-pyrano[2,3-h]epicatechin-8-one
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > flavans > hydroxyflavan > catechin > 9,10-dihydro-10-(4-hydroxyphenyl)-pyrano[2,3-h]epicatechin-8-one

Preferred term

9,10-dihydro-10-(4-hydroxyphenyl)-pyrano[2,3-h]epicatechin-8-one  

Type

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

Broader concept

charge

  • 0

formula

  • C24H20O8

inchi

  • InChI=1S/C24H20O8/c25-13-4-1-11(2-5-13)14-9-21(30)31-20-10-17(27)15-8-19(29)23(32-24(15)22(14)20)12-3-6-16(26)18(28)7-12/h1-7,10,14,19,23,25-29H,8-9H2/t14-,19+,23+/m0/s1

inchikey

  • NHAIWTJLRMSZKP-LEDSTXDGSA-N

mass

  • 436.416

monoisotopicmass

  • 436.11582

smiles

  • O1[C@@H]([C@H](O)CC2=C1C=3[C@@H](CC(OC3C=C2O)=O)C4=CC=C(O)C=C4)C5=CC(O)=C(O)C=C5

subset

  • 2_STAR

synonym EXACT

  • (2R,3R,10S)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-10-(4-hydroxyphenyl)-3,4,9,10-tetrahydro-2H-pyrano[2,3-]chromen-8-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168028

Download this concept: