CHEBI:4934 - Eupatocunoxin

ChEBI IDCHEBI:4934
ChEBI NameEupatocunoxin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H28O8
Net Charge0
Average Mass420.458
Monoisotopic Mass420.17842
SMILES[H][C@@]12/C=C(/C)[C@@H](OC(C)=O)C/C=C(\C)C(OC(=O)[C@]3(C)O[C@@H]3C)C(O)[C@@]1([H])C(=C)C(=O)O2
InChIInChI=1S/C22H28O8/c1-10-7-8-15(27-14(5)23)11(2)9-16-17(12(3)20(25)28-16)18(24)19(10)29-21(26)22(6)13(4)30-22/h7,9,13,15-19,24H,3,8H2,1-2,4-6H3/b10-7+,11-9-/t13-,15+,16-,17+,18?,19?,22-/m1/s1
InChIKeyUZTYOOVAPGOQDZ-FJQRKXEXSA-N
ChEBI Ontology
Outgoing Relation(s)
Eupatocunoxin (CHEBI:4934) is a germacranolide (CHEBI:73011)
Synonym  Source
EupatocunoxinKEGG COMPOUND
Manual XrefsDatabases
C09439KEGG COMPOUND
C00003276KNApSAcK
Registry NumbersSources
CAS:39204-36-9KEGG COMPOUND