1-nitropyrene
(ALRLPDGCPYIVHP-UHFFFAOYSA-N)
Structure
- SMILES
- [O-][N+](=O)c1ccc2c3c1ccc1c3c(cc2)ccc1
- Molecular Formula:
- C16H9NO2
- Molecular Weight:
- 247.248
- Log P:
- 5.0154
- Hydrogen Bond Acceptor:
- 0
- Hydrogen Bond Donor:
- 0
- TPSA:
- 45.82
- CAS Number(s):
- 5522-43-0; 63021-86-3
Synonym(s)
1.
1-nitropyrene
2.
3-nitropyrene
External Link(s)
| MeSH | C032668 |
| PubChem Compound | 21694 |
| ChEBI | 34107 |
| CHEMBL | CHEMBL167395 |
| KEGG | cpd:C14421 |
| ZINC | 157143 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Adenocarcinoma | 9726818 10396879 11746253 | CTD | |
| 2 | Adenoma | 9726818 10396879 | CTD | |
| 3 | Chromosome Breakage | 28633978 | CTD | |
| 4 | Hyperplasia | 9726818 10396879 | CTD | |
| 5 | Leukemia, Experimental | 3829965 8603480 | CTD | |
| 6 | Liver Neoplasms, Experimental | 3731386 | CTD | |
| 7 | Lung Neoplasms | 10396879 | CTD | |
| 8 | Lung diseases | 9726818 | CTD | |
| 9 | Mammary Neoplasms, Experimental | CTD | ||
| 10 | Pulmonary Fibrosis | 29078374 | CTD | |
| 11 | Vulvar Neoplasms | 3829965 | CTD |
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