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CHEBI:85885 - 2-allyl-1-hydroxy-9,10-anthraquinone

ChEBI IDCHEBI:85885
ChEBI Name2-allyl-1-hydroxy-9,10-anthraquinone
Stars
DefinitionA monohydroxyanthraquinone that is 9,10-anthraquinone in which the hydrogens at positions 1 and 2 are replaced by a hydroxy and an allyl group, respectively.
Last Modified14 June 2016
SubmitterMargaret Duesbury
DownloadsMolfile
FormulaC17H12O3
Net Charge0
Average Mass264.280
Monoisotopic Mass264.07864
SMILESC=CCc1ccc2c(c1O)C(=O)c1ccccc1C2=O
InChIInChI=1S/C17H12O3/c1-2-5-10-8-9-13-14(15(10)18)17(20)12-7-4-3-6-11(12)16(13)19/h2-4,6-9,18H,1,5H2
InChIKeyIMUBGIOLZQTIGI-UHFFFAOYSA-N
Roles Classification
Biological Role:
EC 1.4.1.3 {glutamate dehydrogenase [NAD(P)(+)]} inhibitor  An EC 1.4.1.* (oxidoreductase acting on donor CH-NH2 group; NAD+ or NADP+ as acceptor) inhibitor that interferes with the action of glutamate dehydrogenase [NAD(P)+] (EC 1.4.1.3).
ChEBI Ontology
Outgoing Relation(s)
2-allyl-1-hydroxy-9,10-anthraquinone (CHEBI:85885) has role EC 1.4.1.3 {glutamate dehydrogenase [NAD(P)+]} inhibitor (CHEBI:86010)
2-allyl-1-hydroxy-9,10-anthraquinone (CHEBI:85885) is a monohydroxyanthraquinone (CHEBI:37483)
IUPAC Name 
2-allyl-1-hydroxy-9,10-anthraquinone
Synonyms  Source
R162ChEBI
1-hydroxy-2-(prop-2'-enyl)-9,10-anthraquinoneChEBI
1-hydroxy-2-(prop-2'-enyl)anthraquinoneChEBI
2-allyl-1-hydroxy-anthraquinoneChEBI
Registry NumbersSources
Reaxys:2128772Reaxys
Citations