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CHEBI:230767 - erythrinin c

Default Structure
ChEBI IDCHEBI:230767
ChEBI Nameerythrinin c
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O6
Net Charge0
Average Mass354.358
Monoisotopic Mass354.11034
SMILESCC(C)(O)C1Cc2c(cc3occ(-c4ccc(O)cc4)c(=O)c3c2O)O1
InChIInChI=1S/C20H18O6/c1-20(2,24)16-7-12-14(26-16)8-15-17(18(12)22)19(23)13(9-25-15)10-3-5-11(21)6-4-10/h3-6,8-9,16,21-22,24H,7H2,1-2H3
InChIKeyNNBVKGDFOQADTG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
erythrinin c (CHEBI:230767) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
4-hydroxy-6-(4-hydroxyphenyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrouro[3,2-g]chromen-5-one
Manual XrefsDatabases
24842764ChemSpider
LMPK12050181LIPID MAPS