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Substance Name: Benz(a)anthracene-8,9-diol, 8,9,10,11-tetrahydro-, dibenzoate, (8S-cis)-
RN: 91422-92-3
InChIKey: GPIJMUFPIOLLBU-IHLOFXLRSA-N

Molecular Formula

  • C32-H24-O4

Molecular Weight

  • 472.538
 
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Names and Synonyms

  • Benz(a)anthracene-8,9-diol, 8,9,10,11-tetrahydro-, dibenzoate, (8S-cis)-

Registry Numbers

CAS Registry Number

  • 91422-92-3

System Generated Number

  • 0091422923

Structure Descriptors

InChI

1S/C32H24O4/c33-31(22-10-3-1-4-11-22)35-29-18-17-25-19-27-24(16-15-21-9-7-8-14-26(21)27)20-28(25)30(29)36-32(34)23-12-5-2-6-13-23/h1-16,19-20,29-30H,17-18H2/t29-,30+/m1/s1

InChIKey

GPIJMUFPIOLLBU-IHLOFXLRSA-N

Smiles

c12c(ccc3cc4[C@@H]([C@@H](CCc4cc13)OC(c1ccccc1)=O)OC(c1ccccc1)=O)cccc2