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CHEBI:168876 - Muscomin

ChEBI IDCHEBI:168876
ChEBI NameMuscomin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H18O7
Net Charge0
Average Mass346.335
Monoisotopic Mass346.10525
SMILESCOc1c(O)c2c(c(O)c1OC)C(=O)C(Cc1ccc(O)cc1)CO2
InChIInChI=1S/C18H18O7/c1-23-17-14(21)12-13(20)10(7-9-3-5-11(19)6-4-9)8-25-16(12)15(22)18(17)24-2/h3-6,10,19,21-22H,7-8H2,1-2H3
InChIKeyPGCPWPPPMWXCMG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Muscomin (CHEBI:168876) is a homoflavonoid (CHEBI:73233)
IUPAC Name 
5,8-dihydroxy-3-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2,3-dihydrochromen-4-one
Manual XrefsDatabases
HMDB0037250HMDB
10254757ChemSpider