CHEBI:67545 - cochinchinoxanthone

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ChEBI Name cochinchinoxanthone
ChEBI ID CHEBI:67545
Definition A polycyclic cage xanthone isolated from the stems of Cratoxylum cochinchinense and has been shown to exhibit cytotoxic activity against human colon cancer cell line.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C23H24O6
Net Charge 0
Average Mass 396.43310
Monoisotopic Mass 396.15729
InChI InChI=1S/C23H24O6/c1-11(2)5-6-22-20(27)12-7-14-19(26)18-15(25)9-13(24)10-16(18)28-23(14,22)17(8-12)21(3,4)29-22/h5,7,9-10,12,17,24-25H,6,8H2,1-4H3/t12-,17+,22+,23-/m0/s1
InChIKey XCRBRZWMQVMPIY-OJVGWFQVSA-N
SMILES CC(C)=CC[C@]12OC(C)(C)[C@H]3C[C@H](C=C4C(=O)c5c(O)cc(O)cc5O[C@]134)C2=O
Metabolite of Species Details
Cratoxylum cochinchinense (NCBI:txid271749) Found in stem (BTO:0001300). Methanolic extract of dried and ground stems See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cochinchinoxanthone (CHEBI:67545) has role antineoplastic agent (CHEBI:35610)
cochinchinoxanthone (CHEBI:67545) has role metabolite (CHEBI:25212)
cochinchinoxanthone (CHEBI:67545) has role plant metabolite (CHEBI:76924)
cochinchinoxanthone (CHEBI:67545) is a cyclic ether (CHEBI:37407)
cochinchinoxanthone (CHEBI:67545) is a cyclic ketone (CHEBI:3992)
cochinchinoxanthone (CHEBI:67545) is a organic heteropentacyclic compound (CHEBI:38164)
cochinchinoxanthone (CHEBI:67545) is a phenols (CHEBI:33853)
cochinchinoxanthone (CHEBI:67545) is a polycyclic cage (CHEBI:33640)
IUPAC Name
(1S,3aR,5R,12aR)-8,10-dihydroxy-3,3-dimethyl-1-(3-methylbut-2-en-1-yl)-3,3a,4,5-tetrahydro-7H-1,5-methanofuro[3,4-d]xanthene-7,13-dione
Registry Number Type Source
21559758 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21428375 PubMed citation Europe PMC
Last Modified
11 December 2013