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CHEBI:175406 - beta-Mangostin

ChEBI IDCHEBI:175406
ChEBI Namebeta-Mangostin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28O6
Net Charge0
Average Mass424.493
Monoisotopic Mass424.18859
SMILESCOc1cc2oc3cc(O)c(OC)c(CC=C(C)C)c3c(=O)c2c(O)c1CC=C(C)C
InChIInChI=1S/C25H28O6/c1-13(2)7-9-15-18(29-5)12-20-22(23(15)27)24(28)21-16(10-8-14(3)4)25(30-6)17(26)11-19(21)31-20/h7-8,11-12,26-27H,9-10H2,1-6H3
InChIKeyYRKKJHJIWCRNCW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
beta-Mangostin (CHEBI:175406) is a xanthones (CHEBI:51149)
IUPAC Name 
1,6-dihydroxy-3,7-dimethoxy-2,8-bis(3-methylbut-2-enyl)xanthen-9-one
Manual XrefsDatabases
HMDB0036596HMDB
4593093ChemSpider