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CHEBI:6693 - Marchantin A

ChEBI IDCHEBI:6693
ChEBI NameMarchantin A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC28H24O5
Net Charge0
Average Mass440.495
Monoisotopic Mass440.16237
SMILESOc1cc2cc(c1O)Oc1ccc(cc1)CCc1cccc(O)c1Oc1cccc(c1)CC2
InChIInChI=1S/C28H24O5/c29-24-6-2-4-21-12-9-18-10-13-22(14-11-18)32-26-17-20(16-25(30)27(26)31)8-7-19-3-1-5-23(15-19)33-28(21)24/h1-6,10-11,13-17,29-31H,7-9,12H2
InChIKeyLLMFFOXSSQHNFR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Marchantin A (CHEBI:6693) is a phenylpropanoid (CHEBI:26004)
Synonym  Source
Marchantin AKEGG COMPOUND
Manual XrefsDatabases
C10270KEGG COMPOUND
C00002890KNApSAcK
Registry NumbersSources
CAS:88418-46-6KEGG COMPOUND