Benzyl-(1-hydroxyethyl)-(2-hydroxypropyl)-[(1e)-octadeca-1,17-dienyl]azanium (CHEM346956)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 16:32:23 UTC | ||||||||
| Update Date | 2026-08-31 16:32:23 UTC | ||||||||
| Accession Number | CHEM346956 | ||||||||
| Identification | |||||||||
| Common Name | Benzyl-(1-hydroxyethyl)-(2-hydroxypropyl)-[(1e)-octadeca-1,17-dienyl]azanium | ||||||||
| Class | Small Molecule | ||||||||
| Description | Benzyl-(1-hydroxyethyl)-(2-hydroxypropyl)-[(1e)-octadeca-1,17-dienyl]azanium is a compound with the formula C30H52NO2+. It has an average molecular weight of 458.70 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C30H52NO2+ | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 458.400 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | Benzyl-(1-hydroxyethyl)-(2-hydroxypropyl)-[(1e)-octadeca-1,17-dienyl]azanium | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(C[N+](CC1=CC=CC=C1)(C=CCCCCCCCCCCCCCCC=C)C(C)O)O | ||||||||
| InChI Identifier | InChI=1S/C30H52NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-31(29(3)33,26-28(2)32)27-30-23-20-19-21-24-30/h4,19-25,28-29,32-33H,1,5-18,26-27H2,2-3H3/q+1/b25-22+ | ||||||||
| InChI Key | XOXCYUOCFYCRSI-YYDJUVGSSA-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 | ||||||||
