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CHEBI:211246 - Chlorocarolide B

ChEBI IDCHEBI:211246
ChEBI NameChlorocarolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H13ClO4
Net Charge0
Average Mass220.652
Monoisotopic Mass220.05024
SMILESC[C@@H](O)[C@@H](Cl)/C=C1/C(=O)O[C@H](C)[C@@H]1O
InChIInChI=1S/C9H13ClO4/c1-4(11)7(10)3-6-8(12)5(2)14-9(6)13/h3-5,7-8,11-12H,1-2H3/b6-3+/t4-,5-,7+,8+/m1/s1
InChIKeyPYNWQICKVFMNQB-MWTMXDTOSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - DOI (10.1016/0040-4039(96)00277-8)
ChEBI Ontology
Outgoing Relation(s)
Chlorocarolide B (CHEBI:211246) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(3E,4R,5R)-3-[(2S,3R)-2-chloro-3-hydroxybutylidene]-4-hydroxy-5-methyloxolan-2-one
Manual XrefsDatabases
78438515ChemSpider