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CHEBI:214811 - Cordycepsidone B

ChEBI IDCHEBI:214811
ChEBI NameCordycepsidone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H12O9
Net Charge0
Average Mass372.285
Monoisotopic Mass372.04813
SMILESCc1cc(O)c(C(=O)O)c2c1C(=O)Oc1c(C)c3c(c(O)c1O2)C(=O)OC3
InChIInChI=1S/C18H12O9/c1-5-3-8(19)11(16(21)22)14-9(5)18(24)27-13-6(2)7-4-25-17(23)10(7)12(20)15(13)26-14/h3,19-20H,4H2,1-2H3,(H,21,22)
InChIKeyUMJHLAVMGJSVIL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ophiocordyceps dipterigena (ncbitaxon:235378) - PubMed (22707798)
Roles Classification
Application:
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
Cordycepsidone B (CHEBI:214811) is a phthalate ester (CHEBI:35484)
IUPAC Name 
5,18-dihydroxy-7,12-dimethyl-9,16-dioxo-2,10,15-trioxatetracyclo[9.7.0.03,8.013,17]octadeca-1(11),3(8),4,6,12,17-hexaene-4-carboxylic acid
Manual XrefsDatabases
78435356ChemSpider