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CHEBI:4401 - Denudatin B

ChEBI IDCHEBI:4401
ChEBI NameDenudatin B
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H24O5
Net Charge0
Average Mass356.418
Monoisotopic Mass356.16237
SMILESC=CCC1=C[C@]2(OC)C(=CC1=O)O[C@H](c1ccc(OC)c(OC)c1)[C@H]2C
InChIInChI=1S/C21H24O5/c1-6-7-15-12-21(25-5)13(2)20(26-19(21)11-16(15)22)14-8-9-17(23-3)18(10-14)24-4/h6,8-13,20H,1,7H2,2-5H3/t13-,20+,21-/m1/s1
InChIKeyVDYACOATPFOZIO-HBUDHLSFSA-N
ChEBI Ontology
Outgoing Relation(s)
Denudatin B (CHEBI:4401) is a benzofurans (CHEBI:35259)
Synonym  Source
Denudatin BKEGG COMPOUND
Manual XrefsDatabases
C10554KEGG COMPOUND
C00000671KNApSAcK
Registry NumbersSources
CAS:87402-88-8KEGG COMPOUND