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CHEBI:135802 - tritoqualine

ChEBI IDCHEBI:135802
ChEBI Nametritoqualine
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC26H32N2O8
Net Charge0
Average Mass500.548
Monoisotopic Mass500.21587
SMILESCCOc1c(N)c2c(c(OCC)c1OCC)C(C1c3c(cc4c(c3OC)OCO4)CCN1C)OC2=O
InChIInChI=1S/C26H32N2O8/c1-6-31-23-17-16(18(27)24(32-7-2)25(23)33-8-3)26(29)36-21(17)19-15-13(9-10-28(19)4)11-14-20(22(15)30-5)35-12-34-14/h11,19,21H,6-10,12,27H2,1-5H3
InChIKeyIRGJVQIJENCTQF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
tritoqualine (CHEBI:135802) is a isoquinolines (CHEBI:24922)
Synonyms  Source
inhibostaminDrugCentral
tritocalineDrugCentral
hypostamineDrugCentral
hypostaminDrugCentral
Manual XrefsDatabases
2765DrugCentral
HMDB0240249HMDB
Registry NumbersSources
CAS:14504-73-5DrugCentral