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Substance Name: 8-Dichloroacetoxy-9-hydroxy-8,9-dihydroaflatoxin B1
RN: 75084-24-1
InChIKey: QBYDMRFLKRAJAC-UDORUHSDSA-N

Molecular Weight

  • 457.2166
 
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Names and Synonyms

Results Name

  • 8-Dichloroacetoxy-9-hydroxy-8,9-dihydroaflatoxin B1

Synonyms

  • 1,2,3,6a,8,9,9a,11-Octahydro-9-hydroxy-4-methoxy-1,11-dioxocyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-8-yl dichloroacetate (6aS-(6aalpha,8beta,9alpha,9aalpha))-
  • 8-Dichloroacetoxy-9-hydroxy-8,9-dihydroaflatoxin B1

Systematic Name

  • Acetic acid, dichloro-, 1,2,3,6a,8,9,9a,11-octahydro-9-hydroxy-4-methoxy-1,11-dioxocyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-8-yl ester, (6aS-(6aalpha,8beta,9alpha,9aalpha))-

Registry Numbers

CAS Registry Number

  • 75084-24-1

System Generated Number

  • 0075084241

Structure Descriptors

InChI

1S/C19H14Cl2O9/c1-26-7-4-8-11(14-10(7)5-2-3-6(22)9(5)16(24)28-14)12-13(23)19(30-18(12)27-8)29-17(25)15(20)21/h4,12-13,15,18-19,23H,2-3H2,1H3/t12-,13-,18+,19-/m1/s1

InChIKey

QBYDMRFLKRAJAC-UDORUHSDSA-N

Smiles

COc1cc2O[C@H]3O[C@@H](OC(=O)C(Cl)Cl)[C@H](O)[C@H]3c2c4OC(=O)C5=C(CCC5=O)c14