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CHEBI:71184 - 2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione

ChEBI IDCHEBI:71184
ChEBI Name2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione
Stars
DefinitionA naphthoquinone that is naphthalene-1,4-dione substituted by a hydroxy group and a 2-hydroxyethyl group at positions 2 and 3 respectively.
Last Modified9 June 2016
Submitternamrata
DownloadsMolfile
FormulaC12H10O4
Net Charge0
Average Mass218.208
Monoisotopic Mass218.05791
SMILESO=C1C(O)=C(CCO)C(=O)c2ccccc21
InChIInChI=1S/C12H10O4/c13-6-5-9-10(14)7-3-1-2-4-8(7)11(15)12(9)16/h1-4,13,16H,5-6H2
InChIKeyXMPOZGVQVZPRFL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione (CHEBI:71184) is a diol (CHEBI:23824)
2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione (CHEBI:71184) is a hydroxy-1,4-naphthoquinone (CHEBI:132157)
2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione (CHEBI:71184) is conjugate acid of 3-(2-hydroxyethyl)-1,4-dioxo-1,4-dihydronaphthalen-2-olate (CHEBI:71183)
Incoming Relation(s)
3-(2-hydroxyethyl)-1,4-dioxo-1,4-dihydronaphthalen-2-olate (CHEBI:71183) is conjugate base of 2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione (CHEBI:71184)
IUPAC Name 
2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione
Registry NumbersSources
Reaxys:9562455Reaxys