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CHEBI:186168 - Brosimacutin G

ChEBI IDCHEBI:186168
ChEBI NameBrosimacutin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O6
Net Charge0
Average Mass356.374
Monoisotopic Mass356.12599
SMILES[H][C@]1(C(C)(C)O)Oc2ccc(C(=O)/C=C/c3ccc(O)cc3)c(O)c2[C@@H]1O
InChIInChI=1S/C20H20O6/c1-20(2,25)19-18(24)16-15(26-19)10-8-13(17(16)23)14(22)9-5-11-3-6-12(21)7-4-11/h3-10,18-19,21,23-25H,1-2H3/b9-5+/t18-,19-/m0/s1
InChIKeyKJPLNWFZFTXFPY-FQMXMGHCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Brosimacutin G (CHEBI:186168) is a chalcones (CHEBI:23086)
IUPAC Name 
(E)-1-[(2S,3S)-3,4-dihydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzouran-5-yl]-3-(4-hydroxyphenyl)prop-2-en-1-one
Manual XrefsDatabases
9500691ChemSpider
LMPK12120035LIPID MAPS