EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:212205 - Phomopsichin D

ChEBI IDCHEBI:212205
ChEBI NamePhomopsichin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O7
Net Charge0
Average Mass308.286
Monoisotopic Mass308.08960
SMILESCOC(=O)c1cc(O)cc2oc(C[C@H](C)O)c(CO)c(=O)c12
InChIInChI=1S/C15H16O7/c1-7(17)3-11-10(6-16)14(19)13-9(15(20)21-2)4-8(18)5-12(13)22-11/h4-5,7,16-18H,3,6H2,1-2H3/t7-/m0/s1
InChIKeyAJFJHVAIVJZVEW-ZETCQYMHSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - PubMed (27879655)
ChEBI Ontology
Outgoing Relation(s)
Phomopsichin D (CHEBI:212205) is a chromones (CHEBI:23238)
IUPAC Name 
methyl 7-hydroxy-3-(hydroxymethyl)-2-[(2S)-2-hydroxypropyl]-4-oxochromene-5-carboxylate
Manual XrefsDatabases
78443338ChemSpider