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CHEBI:181492 - Murrangatin

ChEBI IDCHEBI:181492
ChEBI NameMurrangatin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O5
Net Charge0
Average Mass276.288
Monoisotopic Mass276.09977
SMILESC=C(C)C(O)C(O)c1c(OC)ccc2ccc(=O)oc12
InChIInChI=1S/C15H16O5/c1-8(2)13(17)14(18)12-10(19-3)6-4-9-5-7-11(16)20-15(9)12/h4-7,13-14,17-18H,1H2,2-3H3
InChIKeyDKEANOQWICTXTP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
ChEBI Ontology
Outgoing Relation(s)
Murrangatin (CHEBI:181492) is a coumarins (CHEBI:23403)
IUPAC Name 
8-(1,2-dihydroxy-3-methylbut-3-enyl)-7-methoxychromen-2-one
Manual XrefsDatabases
344765ChemSpider
HMDB0132703HMDB