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CHEBI:213781 - Dichotomocej E

ChEBI IDCHEBI:213781
ChEBI NameDichotomocej E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26N2O6
Net Charge0
Average Mass438.480
Monoisotopic Mass438.17909
SMILESCOC(=O)c1cnc(Cc2cc(OC)c(OC)c(OC)c2)c(Cc2ccc(OC)cc2)n1
InChIInChI=1S/C24H26N2O6/c1-28-17-8-6-15(7-9-17)10-19-18(25-14-20(26-19)24(27)32-5)11-16-12-21(29-2)23(31-4)22(13-16)30-3/h6-9,12-14H,10-11H2,1-5H3
InChIKeyUGWFTBAQGBWWLR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Dichotomomyces (ncbitaxon:255780) - PubMed (29986460)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Dichotomocej E (CHEBI:213781) is a pyrazinecarboxylic acid (CHEBI:48345)
IUPAC Name 
methyl 6-[(4-methoxyphenyl)methyl]-5-[(3,4,5-trimethoxyphenyl)methyl]pyrazine-2-carboxylate
Manual XrefsDatabases
71048496ChemSpider