CHEBI:3851 - Conchosin B

ChEBI IDCHEBI:3851
ChEBI NameConchosin B
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H20O6
Net Charge0
Average Mass320.341
Monoisotopic Mass320.12599
SMILES[H][C@@]12OC(=O)C(=C)[C@]1([H])CC[C@H](COC(C)=O)[C@]1(O)C=CC(=O)[C@@]21C
InChIInChI=1S/C17H20O6/c1-9-12-5-4-11(8-22-10(2)18)17(21)7-6-13(19)16(17,3)14(12)23-15(9)20/h6-7,11-12,14,21H,1,4-5,8H2,2-3H3/t11-,12+,14-,16+,17-/m1/s1
InChIKeyNQPJUMKNIKXOLH-BEANVFONSA-N
ChEBI Ontology
Outgoing Relation(s)
Conchosin B (CHEBI:3851) is a sesquiterpene lactone (CHEBI:37667)
Synonym  Source
Conchosin BKEGG COMPOUND
Manual XrefsDatabases
C09373KEGG COMPOUND
C00003234KNApSAcK
Registry NumbersSources
CAS:28625-29-8KEGG COMPOUND