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CHEBI:18227 - sterigmatocystin

ChEBI IDCHEBI:18227
ChEBI Namesterigmatocystin
Stars
DefinitionAn organic heteropentacyclic compound whose skeleton comprises a xanthene ring system ortho-fused to a dihydrofuranofuran moiety. The parent of the class of sterigmatocystins.
Secondary ChEBI IDsCHEBI:9262, CHEBI:15109, CHEBI:26758
Last Modified14 December 2022
DownloadsMolfile
FormulaC18H12O6
Net Charge0
Average Mass324.288
Monoisotopic Mass324.06339
SMILES[H][C@]12OC=C[C@@]1([H])c1c(cc(OC)c3c(=O)c4c(O)cccc4oc13)O2
InChIInChI=1S/C18H12O6/c1-21-11-7-12-13(8-5-6-22-18(8)24-12)17-15(11)16(20)14-9(19)3-2-4-10(14)23-17/h2-8,18-19H,1H3/t8-,18+/m0/s1
InChIKeyUTSVPXMQSFGQTM-DCXZOGHSSA-N
Wikipedia
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
mycotoxin  Poisonous substance produced by fungi.
ChEBI Ontology
Outgoing Relation(s)
sterigmatocystin (CHEBI:18227) has functional parent dihydrodemethylsterigmatocystin (CHEBI:190744)
sterigmatocystin (CHEBI:18227) has role metabolite (CHEBI:25212)
sterigmatocystin (CHEBI:18227) is a sterigmatocystins (CHEBI:26759)
Incoming Relation(s)
11-hydroxy-O-methylsterigmatocystin (CHEBI:72680) has functional parent sterigmatocystin (CHEBI:18227)
IUPAC Name 
(3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one
Synonyms  Source
SterigmatocystinKEGG COMPOUND
8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-oneNIST Chemistry WebBook
UniProt Name  Source
sterigmatocystinUniProt
Manual XrefsDatabases
C00961KEGG COMPOUND
C00961KEGG COMPOUND
LMPK10000001LIPID MAPS
SterigmatocystinWikipedia
C00000563KNApSAcK
Registry NumbersSources
Reaxys:1299458Reaxys
CAS:10048-13-2KEGG COMPOUND
CAS:10048-13-2ChemIDplus
CAS:10048-13-2NIST Chemistry WebBook
Citations