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CHEBI:7639 - Nortrachelogenin

ChEBI IDCHEBI:7639
ChEBI NameNortrachelogenin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H22O7
Net Charge0
Average Mass374.389
Monoisotopic Mass374.13655
SMILESCOc1cc(C[C@H]2COC(=O)[C@]2(O)Cc2ccc(O)c(OC)c2)ccc1O
InChIInChI=1S/C20H22O7/c1-25-17-8-12(3-5-15(17)21)7-14-11-27-19(23)20(14,24)10-13-4-6-16(22)18(9-13)26-2/h3-6,8-9,14,21-22,24H,7,10-11H2,1-2H3/t14-,20-/m0/s1
InChIKeyZITBJWXLODLDRH-XOBRGWDASA-N
ChEBI Ontology
Outgoing Relation(s)
Nortrachelogenin (CHEBI:7639) is a lignan (CHEBI:25036)
Synonym  Source
NortrachelogeninKEGG COMPOUND
Manual XrefsDatabases
C10725KEGG COMPOUND
C00000599KNApSAcK
Registry NumbersSources
CAS:34444-37-6KEGG COMPOUND