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CHEBI:198230 - (2S)-4-(2-chloroethyl)-2-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-3-methyl-1,2-dihydropyrrol-5-one

ChEBI IDCHEBI:198230
ChEBI Name(2S)-4-(2-chloroethyl)-2-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-3-methyl-1,2-dihydropyrrol-5-one
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20ClNO2
Net Charge0
Average Mass269.772
Monoisotopic Mass269.11826
SMILESCC1=C(CCCl)C(=O)N[C@@H]1[C@@H](O)[C@@H]1C=CCCC1
InChIInChI=1S/C14H20ClNO2/c1-9-11(7-8-15)14(18)16-12(9)13(17)10-5-3-2-4-6-10/h3,5,10,12-13,17H,2,4,6-8H2,1H3,(H,16,18)/t10-,12+,13+/m1/s1
InChIKeyIZKIYDNYHNTWOM-WXHSDQCUSA-N
Species of MetaboliteComponentSourceComments
Salinispora (ncbitaxon:168694) - PubMed (16050677)
ChEBI Ontology
Outgoing Relation(s)
(2S)-4-(2-chloroethyl)-2-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-3-methyl-1,2-dihydropyrrol-5-one (CHEBI:198230) is a pyrroline (CHEBI:23763)
IUPAC Name 
(2S)-4-(2-chloroethyl)-2-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-3-methyl-1,2-dihydropyrrol-5-one
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9324997ChemSpider