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CHEBI:37504 - anthrarobin

ChEBI IDCHEBI:37504
ChEBI Nameanthrarobin
Stars
DefinitionAn anthracenetriol having the three hydroxy substituents at the 1-, 2- and 10-positions.
Last Modified18 March 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC14H10O3
Net Charge0
Average Mass226.231
Monoisotopic Mass226.06299
SMILESOc1ccc2c(O)c3ccccc3cc2c1O
InChIInChI=1S/C14H10O3/c15-12-6-5-10-11(14(12)17)7-8-3-1-2-4-9(8)13(10)16/h1-7,15-17H
InChIKeyTZIQWQARHPGHIG-UHFFFAOYSA-N
Roles Classification
Biological Role:
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
ChEBI Ontology
Outgoing Relation(s)
anthrarobin (CHEBI:37504) has role allergen (CHEBI:50904)
anthrarobin (CHEBI:37504) is a anthracenetriol (CHEBI:37505)
IUPAC Name 
anthracene-1,2,10-triol
Synonyms  Source
anthrarobinChemIDplus
1,2,10-anthratriolChemIDplus
3,4,9-trihydroxyanthraceneChemIDplus
3,4-dihydroxyanthranolChemIDplus
1,2,10-trihydroxyanthraceneChEBI
Registry NumbersSources
Beilstein:3531675Beilstein
CAS:577-33-3ChemIDplus
Citations