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CHEBI:172519 - Melilotocarpan B

Default Structure
ChEBI IDCHEBI:172519
ChEBI NameMelilotocarpan B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H14O5
Net Charge0
Average Mass286.283
Monoisotopic Mass286.08412
SMILESCOc1ccc2c(c1O)OCC1c3ccc(O)cc3OC21
InChIInChI=1S/C16H14O5/c1-19-12-5-4-10-15-11(7-20-16(10)14(12)18)9-3-2-8(17)6-13(9)21-15/h2-6,11,15,17-18H,7H2,1H3
InChIKeyQDFJNOVWEADTGJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Melilotocarpan B (CHEBI:172519) is a pterocarpans (CHEBI:26377)
IUPAC Name 
3-methoxy-6a,11a-dihydro-6H-[1]benzouro[3,2-c]chromene-4,9-diol
Manual XrefsDatabases
24843017ChemSpider
HMDB0029527HMDB
LMPK12070077LIPID MAPS