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CHEBI:210152 - Leptazoline A

ChEBI IDCHEBI:210152
ChEBI NameLeptazoline A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14ClNO5
Net Charge0
Average Mass299.710
Monoisotopic Mass299.05605
SMILESC[C@H]1OC(c2cc(Cl)ccc2O)=N[C@@H]1[C@@H](O)CC(=O)O
InChIInChI=1S/C13H14ClNO5/c1-6-12(10(17)5-11(18)19)15-13(20-6)8-4-7(14)2-3-9(8)16/h2-4,6,10,12,16-17H,5H2,1H3,(H,18,19)/t6-,10+,12+/m1/s1
InChIKeyZFAIHGMUJXZHDW-HUABCPSTSA-N
Species of MetaboliteComponentSourceComments
Leptolyngbyaspecies (ncbitaxon:47254) - PubMed (31591889)
ChEBI Ontology
Outgoing Relation(s)
Leptazoline A (CHEBI:210152) is a monochlorophenol (CHEBI:38857)
IUPAC Name 
(3S)-3-[(4R,5R)-2-(5-chloro-2-hydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazol-4-yl]-3-hydroxypropanoic acid