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CHEBI:213223 - Desmethyldichlorodiaportinol

ChEBI IDCHEBI:213223
ChEBI NameDesmethyldichlorodiaportinol
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SubmitterMetaboLights
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FormulaC12H10Cl2O6
Net Charge0
Average Mass321.112
Monoisotopic Mass319.98544
SMILESO=c1oc([C@H](O)[C@H](O)C(Cl)Cl)cc2cc(O)cc(O)c12
InChIInChI=1S/C12H10Cl2O6/c13-11(14)10(18)9(17)7-2-4-1-5(15)3-6(16)8(4)12(19)20-7/h1-3,9-11,15-18H/t9-,10-/m0/s1
InChIKeyPJUHUHPNOWRPNZ-UWVGGRQHSA-N
ChEBI Ontology
Outgoing Relation(s)
Desmethyldichlorodiaportinol (CHEBI:213223) is a isocoumarins (CHEBI:38758)
IUPAC Name 
3-[(1R,2S)-3,3-dichloro-1,2-dihydroxypropyl]-6,8-dihydroxyisochromen-1-one
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64853492ChemSpider