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CHEBI:81628 - 4,5-Chrysenedicarboxylate

ChEBI IDCHEBI:81628
ChEBI Name4,5-Chrysenedicarboxylate
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DownloadsMolfile
FormulaC20H12O4
Net Charge0
Average Mass316.312
Monoisotopic Mass316.07356
SMILESO=C(O)c1cccc2ccc3c4ccccc4cc(C(=O)O)c3c12
InChIInChI=1S/C20H12O4/c21-19(22)15-7-3-5-11-8-9-14-13-6-2-1-4-12(13)10-16(20(23)24)18(14)17(11)15/h1-10H,(H,21,22)(H,23,24)
InChIKeyQBOGQZZZDOFBTQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4,5-Chrysenedicarboxylate (CHEBI:81628) is a carbopolycyclic compound (CHEBI:35294)
Manual XrefsDatabases
C18277KEGG COMPOUND