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CHEBI:214947 - Xialenone C

ChEBI IDCHEBI:214947
ChEBI NameXialenone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O5
Net Charge0
Average Mass226.228
Monoisotopic Mass226.08412
SMILESC=CCC1=C(O)C(=O)[C@]2(O)CC[C@H](O)[C@]12O
InChIInChI=1S/C11H14O5/c1-2-3-6-8(13)9(14)10(15)5-4-7(12)11(6,10)16/h2,7,12-13,15-16H,1,3-5H2/t7-,10+,11+/m0/s1
InChIKeyMXPZYUJYDKXFAJ-WHGOUJPWSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1002/1099-0690(200007)2000:13<2401::aid-ejoc2401>3.0.co;2-y)
ChEBI Ontology
Outgoing Relation(s)
Xialenone C (CHEBI:214947) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(3aR,4S,6aS)-2,3a,4,6a-tetrahydroxy-3-prop-2-enyl-5,6-dihydro-4H-pentalen-1-one
Manual XrefsDatabases
8760695ChemSpider