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CHEBI:212192 - Phomopsichin B

ChEBI IDCHEBI:212192
ChEBI NamePhomopsichin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18O8
Net Charge0
Average Mass350.323
Monoisotopic Mass350.10017
SMILESCOC(=O)c1cc(OC)c(O)c2oc3c(c(=O)c12)[C@@H](OC)O[C@H](C)C3
InChIInChI=1S/C17H18O8/c1-7-5-9-12(17(23-4)24-7)14(19)11-8(16(20)22-3)6-10(21-2)13(18)15(11)25-9/h6-7,17-18H,5H2,1-4H3/t7-,17+/m1/s1
InChIKeyYRKLCQUFDCORNN-GJEGPGMTSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - PubMed (27879655)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Phomopsichin B (CHEBI:212192) is a trihydroxybenzoic acid (CHEBI:27115)
IUPAC Name 
methyl (1S,3R)-6-hydroxy-1,7-dimethoxy-3-methyl-10-oxo-3,4-dihydro-1H-pyrano[4,3-b]chromene-9-carboxylate
Manual XrefsDatabases
60596801ChemSpider