CHEBI:4773 - Elephantopin

ChEBI IDCHEBI:4773
ChEBI NameElephantopin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H20O7
Net Charge0
Average Mass360.362
Monoisotopic Mass360.12090
SMILES[H][C@]12O[C@]1(C)C[C@]1([H])C=C(C[C@H](OC(=O)C(=C)C)[C@@]3([H])C(=C)C(=O)O[C@]23[H])C(=O)O1
InChIInChI=1S/C19H20O7/c1-8(2)16(20)24-12-6-10-5-11(23-18(10)22)7-19(4)15(26-19)14-13(12)9(3)17(21)25-14/h5,11-15H,1,3,6-7H2,2,4H3/t11-,12-,13+,14-,15+,19+/m0/s1
InChIKeyWIQOUTANBFOBPB-KIVXNUBRSA-N
ChEBI Ontology
Outgoing Relation(s)
Elephantopin (CHEBI:4773) is a γ-lactone (CHEBI:37581)
Synonym  Source
ElephantopinKEGG COMPOUND
Manual XrefsDatabases
C09403KEGG COMPOUND
C00000312KNApSAcK
Registry NumbersSources
CAS:13017-11-3KEGG COMPOUND