EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:143868 - 1,3,8-trihydroxy-4-methyl-2,7-diprenylxanthone

ChEBI IDCHEBI:143868
ChEBI Name1,3,8-trihydroxy-4-methyl-2,7-diprenylxanthone
Stars
DefinitionA member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1,3 and 8, prenyl groups at positions 2 and 7, and a methyl group at position 4.
Last Modified17 June 2019
Submittermwilliams
DownloadsMolfile
FormulaC24H26O5
Net Charge0
Average Mass394.467
Monoisotopic Mass394.17802
SMILESCC(C)=CCc1ccc2oc3c(C)c(O)c(CC=C(C)C)c(O)c3c(=O)c2c1O
InChIInChI=1S/C24H26O5/c1-12(2)6-8-15-9-11-17-18(21(15)26)23(28)19-22(27)16(10-7-13(3)4)20(25)14(5)24(19)29-17/h6-7,9,11,25-27H,8,10H2,1-5H3
InChIKeyQPSZSDVSMAQDTD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Garcinia mangostana (ncbitaxon:58228) - Article (Book: Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. CRC press.) Constituent of the fruit hulls.
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
1,3,8-trihydroxy-4-methyl-2,7-diprenylxanthone (CHEBI:143868) has role plant metabolite (CHEBI:76924)
1,3,8-trihydroxy-4-methyl-2,7-diprenylxanthone (CHEBI:143868) is a polyphenol (CHEBI:26195)
1,3,8-trihydroxy-4-methyl-2,7-diprenylxanthone (CHEBI:143868) is a xanthones (CHEBI:51149)
IUPAC Name 
1,3,8-trihydroxy-4-methyl-2,7-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
Synonyms  Source
1,3,8-trihydroxy-4-methyl-2,7-bis(3-methyl-2-buten-1-yl)-9H-xanthen-9-oneChEBI
1,3,8-trihydroxy-4-methyl-2,7-bis(3-methyl-2-butenyl)-9H-xanthen-9-oneChEBI
1,3,8-trihydroxy-4-methyl-2,7-bis(3-methylbut-2-en-1-yl)xanthen-9-oneHMDB
Manual XrefsDatabases
HMDB0037298HMDB
FDB016317FooDB