6-[(3e,5e)-3,5-dimethyl-6-(4-nitrophenyl)hexa-3,5-dienyl]-4-hydroxy-3,5-dimethylpyran-2-one (CHEM323049)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-30 06:00:11 UTC | ||||||||
| Update Date | 2026-08-30 06:00:11 UTC | ||||||||
| Accession Number | CHEM323049 | ||||||||
| Identification | |||||||||
| Common Name | 6-[(3e,5e)-3,5-dimethyl-6-(4-nitrophenyl)hexa-3,5-dienyl]-4-hydroxy-3,5-dimethylpyran-2-one | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C21H23NO5 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 369.158 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 6-[(3e,5e)-3,5-dimethyl-6-(4-nitrophenyl)hexa-3,5-dienyl]-4-hydroxy-3,5-dimethylpyran-2-one | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1=C(OC(=O)C(=C1O)C)CCC(=CC(=CC2=CC=C(C=C2)[N+](=O)[O-])C)C | ||||||||
| InChI Identifier | InChI=1S/C21H23NO5/c1-13(5-10-19-15(3)20(23)16(4)21(24)27-19)11-14(2)12-17-6-8-18(9-7-17)22(25)26/h6-9,11-12,23H,5,10H2,1-4H3/b13-11+,14-12+ | ||||||||
| InChI Key | UERDCRYIPVUCBM-PHEQNACWSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
