EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:226113 - Saccharothriolide C2

ChEBI IDCHEBI:226113
ChEBI NameSaccharothriolide C2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26O7
Net Charge0
Average Mass366.410
Monoisotopic Mass366.16785
SMILESC[C@@H]1[C@@H](O)[C@@H](C)C(=O)[C@@H](C)[C@@H](O)[C@H](C)C(=O)O[C@@H]1c1cc(O)cc(O)c1
InChIInChI=1S/C19H26O7/c1-8-15(22)9(2)17(24)11(4)19(25)26-18(10(3)16(8)23)12-5-13(20)7-14(21)6-12/h5-11,16-18,20-21,23-24H,1-4H3/t8-,9+,10+,11-,16-,17+,18-/m0/s1
InChIKeyFILCWWHFFXLICK-AAWRAVRKSA-N
Species of MetaboliteComponentSourceComments
Saccharothrix (ncbitaxon:2071) - DOI (10.1016/j.tetlet.2019.03.034)
ChEBI Ontology
Outgoing Relation(s)
Saccharothriolide C2 (CHEBI:226113) is a resorcinols (CHEBI:33572)
IUPAC Name 
(3S,4R,5S,7R,8R,9R,10S)-10-(3,5-dihydroxyphenyl)-4,8-dihydroxy-3,5,7,9-tetramethyloxecane-2,6-dione