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CHEBI:5281 - Geigerin

ChEBI IDCHEBI:5281
ChEBI NameGeigerin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILES[H][C@@]12[C@H](C)C(=O)O[C@]1([H])C[C@H](C)[C@@]1([H])CC(=O)C(C)=C1[C@H]2O
InChIInChI=1S/C15H20O4/c1-6-4-11-13(8(3)15(18)19-11)14(17)12-7(2)10(16)5-9(6)12/h6,8-9,11,13-14,17H,4-5H2,1-3H3/t6-,8-,9+,11+,13+,14+/m0/s1
InChIKeyBFWXQSLJSDLIAA-GSGOXJSYSA-N
ChEBI Ontology
Outgoing Relation(s)
Geigerin (CHEBI:5281) is a sesquiterpene lactone (CHEBI:37667)
Synonym  Source
GeigerinKEGG COMPOUND
Manual XrefsDatabases
C09456KEGG COMPOUND
C00003289KNApSAcK
Registry NumbersSources
CAS:436-45-3KEGG COMPOUND