1-(2,6-Dihydroxy-4-methoxy-3-methylphenyl)butan-1-one (Aspidinol) (CHEM114545)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 01:59:59 UTC | ||||||||
| Update Date | 2026-05-21 01:36:35 UTC | ||||||||
| Accession Number | CHEM114545 | ||||||||
| Identification | |||||||||
| Common Name | 1-(2,6-Dihydroxy-4-methoxy-3-methylphenyl)butan-1-one (Aspidinol) | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type |
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| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C12H16O4 | ||||||||
| Average Molecular Mass | 224.256 g/mol | ||||||||
| Monoisotopic Mass | 224.105 g/mol | ||||||||
| CAS Registry Number | 519-40-4 | ||||||||
| IUPAC Name | 1-(2,6-Dihydroxy-4-methoxy-3-methylphenyl)butan-1-one | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCC(=O)C1=C(O)C(C)=C(OC)C=C1O | ||||||||
| InChI Identifier | InChI=1S/C12H16O4/c1-4-5-8(13)11-9(14)6-10(16-3)7(2)12(11)15/h6,14-15H,4-5H2,1-3H3 | ||||||||
| InChI Key | GJRJTYFSORWKBE-UHFFFAOYSA-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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
