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Substance Name: Benz(j)aceanthrylene-1,2-diol, 1,2-dihydro-3-methyl-, (1R-trans)-
RN: 132342-17-7
InChIKey: MSPGUHVGYWHMPY-NHCUHLMSSA-N

Molecular Formula

  • C21-H16-O2

Molecular Weight

  • 300.355
 
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Names and Synonyms

Synonym

  • (1R,2R)-3-Methyl-1,2-dihydrobenzo{j)aceanthrylene-1,2-diol

Systematic Name

  • Benz(j)aceanthrylene-1,2-diol, 1,2-dihydro-3-methyl-, (1R-trans)-

Registry Numbers

CAS Registry Number

  • 132342-17-7

System Generated Number

  • 0132342177

Structure Descriptors

InChI

1S/C21H16O2/c1-11-6-7-13-10-16-14-5-3-2-4-12(14)8-9-15(16)19-18(13)17(11)20(22)21(19)23/h2-10,20-23H,1H3/t20-,21-/m1/s1

InChIKey

MSPGUHVGYWHMPY-NHCUHLMSSA-N

Smiles

c12[C@H]([C@@H](c3c4ccc5c(c4cc(ccc1C)c23)cccc5)O)O