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CHEBI:204264 - Pericosine D

Default Structure
ChEBI IDCHEBI:204264
ChEBI NamePericosine D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H11ClO5
Net Charge0
Average Mass222.624
Monoisotopic Mass222.02950
SMILESCOC(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1Cl
InChIInChI=1S/C8H11ClO5/c1-14-8(13)3-2-4(10)6(11)7(12)5(3)9/h2,4-7,10-12H,1H3/t4-,5-,6-,7-/m1/s1
InChIKeyAEDMWQPFIPNFCS-DBRKOABJSA-N
Species of MetaboliteComponentSourceComments
Periconia (ncbitaxon:97971) - DOI (10.1016/j.tetasy.2008.06.008)
ChEBI Ontology
Outgoing Relation(s)
Pericosine D (CHEBI:204264) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
methyl (3R,4R,5S,6R)-6-chloro-3,4,5-trihydroxycyclohexene-1-carboxylate
Manual XrefsDatabases
28285432ChemSpider