[(2r)-3-[[[(2r,3r,5r)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-(11-methyldodecanoyloxy)propyl] 12-methyltridecanoate (CHEM350963)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 23:16:26 UTC | ||||||||
| Update Date | 2026-08-31 23:16:26 UTC | ||||||||
| Accession Number | CHEM350963 | ||||||||
| Identification | |||||||||
| Common Name | [(2r)-3-[[[(2r,3r,5r)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-(11-methyldodecanoyloxy)propyl] 12-methyltridecanoate | ||||||||
| Class | Small Molecule | ||||||||
| Description | [(2r)-3-[[[(2r,3r,5r)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-(11-methyldodecanoyloxy)propyl] 12-methyltridecanoate is a chemical compound with the formula C39H71N3O15P2. With an average molecular weight of 883.90 g/mol, [(2r)-3-[[[(2r,3r,5r)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-(11-methyldodecanoyloxy)propyl] 12-methyltridecanoate is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C39H71N3O15P2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 883.436 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | [(2r)-3-[[[(2r,3r,5r)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-(11-methyldodecanoyloxy)propyl] 12-methyltridecanoate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(C)CCCCCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O)OC(=O)CCCCCCCCCC(C)C | ||||||||
| InChI Identifier | InChI=1S/C39H71N3O15P2/c1-29(2)20-16-12-8-5-6-10-14-18-22-34(43)52-26-31(55-35(44)23-19-15-11-7-9-13-17-21-30(3)4)27-53-58(48,49)57-59(50,51)54-28-32-36(45)37(46)38(56-32)42-25-24-33(40)41-39(42)47/h24-25,29-32,36-38,45-46H,5-23,26-28H2,1-4H3,(H,48,49)(H,50,51)(H2,40,41,47)/t31-,32-,36+,37?,38-/m1/s1 | ||||||||
| InChI Key | BVUBOKMWRISSMF-YPOSWXDASA-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 | ||||||||
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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 | ||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
