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CHEBI:135818 - pirozadil

ChEBI IDCHEBI:135818
ChEBI Namepirozadil
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC27H29NO10
Net Charge0
Average Mass527.526
Monoisotopic Mass527.17915
SMILESCOc1cc(C(=O)OCc2cccc(COC(=O)c3cc(OC)c(OC)c(OC)c3)n2)cc(OC)c1OC
InChIInChI=1S/C27H29NO10/c1-31-20-10-16(11-21(32-2)24(20)35-5)26(29)37-14-18-8-7-9-19(28-18)15-38-27(30)17-12-22(33-3)25(36-6)23(13-17)34-4/h7-13H,14-15H2,1-6H3
InChIKeyDIIBXMIIOQXTHW-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
pirozadil (CHEBI:135818) is a trihydroxybenzoic acid (CHEBI:27115)
Synonym  Source
pemixDrugCentral
Manual XrefsDatabases
2212DrugCentral
Registry NumbersSources
CAS:54110-25-7DrugCentral