dibenz[a,i]acridine

Synonyms: "dibenz(a,i)acridine", "dibenzo(a,i)acridine", "dibenzo[a,i]acridine".

Source: dibenz[a,i]acridine is formed during the incomplete burning of organic matter.-

Identifiers:

IUPAC Name: 13-azapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(22),2,4,6,8,10,12,14,16,18,20-undecaene
CAS Number: 226-92-6
PubChem ID: 164567
InChiKey: MRXMZJQYYWLOCW-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C2C(=C1)C=CC3=NC4=CC5=CC=CC=C5C=C4C=C32

Structural Properties:

Molecular Formula: C₂₁H₁₃N
Molecular Weight: 279.342

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 1
Number of atoms different from hydrogen: 22

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3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Benisek M, Blaha L, Hilscherova K. 2008. Interference of PAHs and their N-heterocyclic analogs with signaling of retinoids in vitro. Toxicol in Vitro 22(8):1909-1917. DOI: 10.1016/j.tiv.2008.09.009. URL: http://www.sciencedirect.com/science/article/pii/S0887233308002373?via%3Dihub.