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CHEBI:66057 - hyperxanthone C

ChEBI IDCHEBI:66057
ChEBI Namehyperxanthone C
Stars
DefinitionA member of the class of xanthones that is 2,3,6,8-tetrahydroxyxanthone substituted by a 2-hydroxy-3-methylbut-3-enyl group at position 1. Isolated from the aerial parts of Hypericum scabrum, it exhibits cytotoxicity for human tumour cells.
Last Modified27 February 2013
DownloadsMolfile
FormulaC18H16O7
Net Charge0
Average Mass344.319
Monoisotopic Mass344.08960
SMILESC=C(C)C(O)Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
InChIInChI=1S/C18H16O7/c1-7(2)10(20)5-9-15-14(6-12(22)17(9)23)25-13-4-8(19)3-11(21)16(13)18(15)24/h3-4,6,10,19-23H,1,5H2,2H3
InChIKeyGONMHOQVFDWXLV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Hypericum scabrum (IPNI:433837-1) - PubMed (15568778)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
hyperxanthone C (CHEBI:66057) has role antineoplastic agent (CHEBI:35610)
hyperxanthone C (CHEBI:66057) has role metabolite (CHEBI:25212)
hyperxanthone C (CHEBI:66057) is a polyphenol (CHEBI:26195)
hyperxanthone C (CHEBI:66057) is a secondary alcohol (CHEBI:35681)
hyperxanthone C (CHEBI:66057) is a xanthones (CHEBI:51149)
IUPAC Name 
2,3,6,8-tetrahydroxy-1-(2-hydroxy-3-methylbut-3-en-1-yl)-9H-xanthen-9-one
Registry NumbersSources
Reaxys:11309674Reaxys
Citations