10142-57-1 Purity
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Specification
The molecular formula of dibenzanthrone is C34H16O2.
The molecular weight of dibenzanthrone is 456.5 g/mol.
Dibenzanthrone was created on March 26, 2005.
The IUPAC name of dibenzanthrone is nonacyclo[18.10.2.2 2,5 .0 3,16 .0 4,13 .0 6,11 .0 17,31 .0 22,27 .0 28,32 ]tetratriaconta-1(31),2,4,6,8,10,13,15,17,19,22,24,26,28(32),29,33-hexadecaene-12,21-dione.
The InChI of dibenzanthrone is InChI=1S/C34H16O2/c35-33-25-7-3-1-5-17(25)19-9-11-21-22-12-10-20-18-6-2-4-8-26(18)34(36)28-16-14-24(30(22)32(20)28)23-13-15-27(33)31(19)29(21)23/h1-16H.
The InChIKey of dibenzanthrone is YKSGNOMLAIJTLT-UHFFFAOYSA-N.
The canonical SMILES of dibenzanthrone is C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C9=CC=CC=C9C8=O)C2=O.
The CAS number of dibenzanthrone is 116-71-2.
The UNII of dibenzanthrone is VH1DQP6QPQ.
The ChEMBL ID of dibenzanthrone is CHEMBL344254.