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Substance Name: Benz(a)anthracene-3,4-diol, 1,2,3,4-tetrahydro-, dibenzoate, trans-
RN: 60968-09-4
InChIKey: XESLQACFUXWXLZ-KYJUHHDHSA-N

Molecular Formula

  • C32-H24-O4

Molecular Weight

  • 472.538
 
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Names and Synonyms

  • Benz(a)anthracene-3,4-diol, 1,2,3,4-tetrahydro-, dibenzoate, trans-

Registry Numbers

CAS Registry Number

  • 60968-09-4

System Generated Number

  • 0060968094

Structure Descriptors

InChI

1S/C32H24O4/c33-31(21-9-3-1-4-10-21)35-29-18-17-26-27(30(29)36-32(34)22-11-5-2-6-12-22)16-15-25-19-23-13-7-8-14-24(23)20-28(25)26/h1-16,19-20,29-30H,17-18H2/t29-,30-/m0/s1

InChIKey

XESLQACFUXWXLZ-KYJUHHDHSA-N

Smiles

c12c(ccc3cc4ccccc4cc13)[C@@H]([C@H](CC2)OC(c1ccccc1)=O)OC(c1ccccc1)=O