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CHEBI:25956 - 9,10-phenanthrenediyl bissulfate

ChEBI IDCHEBI:25956
ChEBI Name9,10-phenanthrenediyl bissulfate
Stars
Last Modified23 March 2007
DownloadsMolfile
FormulaC14H8O8S2
Net Charge-2
Average Mass368.344
Monoisotopic Mass367.96716
SMILESO=S(=O)([O-])Oc1c(OS(=O)(=O)[O-])c2ccccc2c2ccccc12
InChIInChI=1S/C14H10O8S2/c15-23(16,17)21-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)22-24(18,19)20/h1-8H,(H,15,16,17)(H,18,19,20)/p-2
InChIKeyWTIHMYOACRETPQ-UHFFFAOYSA-L
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
9,10-phenanthrenediyl bissulfate (CHEBI:25956) has functional parent phenanthrene-9,10-diol (CHEBI:20814)
9,10-phenanthrenediyl bissulfate (CHEBI:25956) is a phenanthrenediyl bissulfate (CHEBI:25958)
IUPAC Name 
phenanthrene-9,10-diyl bissulfate
Synonyms  Source
9,10-phenanthryl-disulfateUM-BBD
phenanthrene-9,10-dihydrodiolsulfate conjugateUM-BBD
Manual XrefsDatabases
c0530UM-BBD