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CHEBI:142870 - demethylluteothin(1−)

Default Structure
ChEBI IDCHEBI:142870
ChEBI Namedemethylluteothin(1−)
Stars
ASCII Namedemethylluteothin(1-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC21H22NO5
Net Charge-1
Average Mass368.409
Monoisotopic Mass368.15035
SMILESCC(=C\c1ccc([N+](=O)[O-])cc1)/C=C(\C)CCc1oc([O-])c(C)c(=O)c1C
InChIInChI=1S/C21H23NO5/c1-13(5-10-19-15(3)20(23)16(4)21(24)27-19)11-14(2)12-17-6-8-18(9-7-17)22(25)26/h6-9,11-12,24H,5,10H2,1-4H3/p-1/b13-11+,14-12+
InChIKeyTWLUULBJSDGQQK-PHEQNACWSA-M
ChEBI Ontology
Outgoing Relation(s)
demethylluteothin(1−) (CHEBI:142870) is a organic molecular entity (CHEBI:50860)
UniProt Name  Source
demethylluteothinUniProt
Manual XrefsDatabases
CPD-21801MetaCyc
Citations