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CHEBI:81272 - Neoarctin B

ChEBI IDCHEBI:81272
ChEBI NameNeoarctin B
Stars
DownloadsMolfile
FormulaC42H46O12
Net Charge0
Average Mass742.818
Monoisotopic Mass742.29893
SMILESCOc1cc(CC2COC(=O)C2Cc2cc(OC)c(O)c(OC)c2)ccc1-c1ccc(CC2COC(=O)C2Cc2cc(OC)c(O)c(OC)c2)cc1OC
InChIInChI=1S/C42H46O12/c1-47-33-15-23(11-27-21-53-41(45)31(27)13-25-17-35(49-3)39(43)36(18-25)50-4)7-9-29(33)30-10-8-24(16-34(30)48-2)12-28-22-54-42(46)32(28)14-26-19-37(51-5)40(44)38(20-26)52-6/h7-10,15-20,27-28,31-32,43-44H,11-14,21-22H2,1-6H3
InChIKeyTYEFCPJCPSRVMT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Neoarctin B (CHEBI:81272) is a lignan (CHEBI:25036)
Manual XrefsDatabases
C17683KEGG COMPOUND