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CHEBI:215205 - Oxisterigmatocystin I

ChEBI IDCHEBI:215205
ChEBI NameOxisterigmatocystin I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H16O7
Net Charge0
Average Mass356.330
Monoisotopic Mass356.08960
SMILESCOc1cc2c(c3oc4cccc(O)c4c(=O)c13)[C@@H]1C[C@@H](OC)O[C@@H]1O2
InChIInChI=1S/C19H16O7/c1-22-11-7-12-14(8-6-13(23-2)26-19(8)25-12)18-16(11)17(21)15-9(20)4-3-5-10(15)24-18/h3-5,7-8,13,19-20H,6H2,1-2H3/t8-,13-,19-/m0/s1
InChIKeyIWOYVIQOJCFZEP-PVYSZQQSSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.phytol.2018.06.009)
Roles Classification
Biological Role:
mycotoxin  Poisonous substance produced by fungi.
ChEBI Ontology
Outgoing Relation(s)
Oxisterigmatocystin I (CHEBI:215205) is a sterigmatocystins (CHEBI:26759)
IUPAC Name 
(3S,5S,7S)-15-hydroxy-5,11-dimethoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,9,11,14,16,18-hexaen-13-one
Manual XrefsDatabases
71048402ChemSpider