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CHEBI:224238 - Chlorosphaerolactylate B

ChEBI IDCHEBI:224238
ChEBI NameChlorosphaerolactylate B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H27ClO4
Net Charge0
Average Mass306.830
Monoisotopic Mass306.15979
SMILESC[C@H](OC(=O)CCCCCCCCCCCCl)C(=O)O
InChIInChI=1S/C15H27ClO4/c1-13(15(18)19)20-14(17)11-9-7-5-3-2-4-6-8-10-12-16/h13H,2-12H2,1H3,(H,18,19)/t13-/m0/s1
InChIKeySFJAMELRYCBOPH-ZDUSSCGKSA-N
Species of MetaboliteComponentSourceComments
Sphaerospermopsisspecies LEGE 00249 (ncbitaxon:1380707) - PubMed (32479093)
ChEBI Ontology
Outgoing Relation(s)
Chlorosphaerolactylate B (CHEBI:224238) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
2-(12-chlorododecanoyloxy)propanoic acid
Manual XrefsDatabases
113368724ChemSpider