EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:146785 - polymatin A

ChEBI IDCHEBI:146785
ChEBI Namepolymatin A
Stars
Submittermwilliams
DownloadsMolfile
FormulaC21H26O7
Net Charge0
Average Mass390.432
Monoisotopic Mass390.16785
SMILES[H][C@@]12/C=C(\C)CC/C=C(/C(=O)OC)[C@@H](O)[C@H](OC(=O)/C(C)=C\C)[C@]1([H])C(=C)C(=O)O2
InChIInChI=1S/C21H26O7/c1-6-12(3)19(23)28-18-16-13(4)20(24)27-15(16)10-11(2)8-7-9-14(17(18)22)21(25)26-5/h6,9-10,15-18,22H,4,7-8H2,1-3,5H3/b11-10-,12-6-,14-9+/t15-,16-,17-,18-/m1/s1
InChIKeyGPNBBLNJDPYZAB-CCBFTCNTSA-N
Species of MetaboliteComponentSourceComments
Smallanthus sonchifolius (ncbitaxon:185202) leaf lamina (BTO:0000719) PubMed (18239309)
ChEBI Ontology
Outgoing Relation(s)
polymatin A (CHEBI:146785) is a sesquiterpene lactone (CHEBI:37667)