EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:192294 - Artomunoxanthentrione epoxide

ChEBI IDCHEBI:192294
ChEBI NameArtomunoxanthentrione epoxide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H22O8
Net Charge0
Average Mass462.454
Monoisotopic Mass462.13147
SMILESC=C(C)C1=CC23OC4(C(=O)C=C(OC)C(=O)C14)C2Oc1c2c(cc(O)c1C3=O)OC(C)(C)C=C2
InChIInChI=1S/C26H22O8/c1-11(2)13-10-25-22(30)18-14(27)8-15-12(6-7-24(3,4)33-15)21(18)32-23(25)26(34-25)17(28)9-16(31-5)20(29)19(13)26/h6-10,19,23,27H,1H2,2-5H3
InChIKeyNDLOJOBMSNOREU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ovis aries (ncbitaxon:9940) Rumen (NCIT:C98778) MetaboLights (MTBLS3683)
ChEBI Ontology
Outgoing Relation(s)
Artomunoxanthentrione epoxide (CHEBI:192294) is a pyranoxanthones (CHEBI:71238)
IUPAC Name 
12-hydroxy-20-methoxy-8,8-dimethyl-17-prop-1-en-2-yl-3,9,23-trioxahexacyclo[13.7.1.01,18.02,15.04,13.05,10]tricosa-4(13),5(10),6,11,16,20-hexaene-14,19,22-trione
Manual XrefsDatabases
35014957ChemSpider
HMDB0040533HMDB