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CHEBI:146154 - ilicicolin A(1−)

ChEBI IDCHEBI:146154
ChEBI Nameilicicolin A(1−)
Stars
ASCII Nameilicicolin A(1-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC23H30ClO3
Net Charge-1
Average Mass389.943
Monoisotopic Mass389.18890
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/Cc1c([O-])c(Cl)c(C)c(C=O)c1O
InChIInChI=1S/C23H31ClO3/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-19-22(26)20(14-25)18(5)21(24)23(19)27/h8,10,12,14,26-27H,6-7,9,11,13H2,1-5H3/p-1/b16-10+,17-12+
InChIKeyMHWOMRMBQGSTFS-JTCWOHKRSA-M
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
ilicicolin A(1−) (CHEBI:146154) is a phenolate (CHEBI:50526)
UniProt Name  Source
ilicicolin AUniProt
Citations