(1r,9s,13r)-10-[2-(1,3-dioxan-2-yl)ethyl]-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol (CHEM320314)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-30 01:37:12 UTC | ||||||||
| Update Date | 2026-08-30 01:37:12 UTC | ||||||||
| Accession Number | CHEM320314 | ||||||||
| Identification | |||||||||
| Common Name | (1r,9s,13r)-10-[2-(1,3-dioxan-2-yl)ethyl]-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C20H29NO3 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 331.215 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | (1r,9s,13r)-10-[2-(1,3-dioxan-2-yl)ethyl]-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1C2CC3=C(C1(CCN2CCC4OCCCO4)C)C=C(C=C3)O | ||||||||
| InChI Identifier | InChI=1S/C20H29NO3/c1-14-18-12-15-4-5-16(22)13-17(15)20(14,2)7-9-21(18)8-6-19-23-10-3-11-24-19/h4-5,13-14,18-19,22H,3,6-12H2,1-2H3/t14-,18-,20+/m0/s1 | ||||||||
| InChI Key | MEIRVPWPDUXAER-ADLFWFRXSA-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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
