[(2r,3s,4s,5r,6s)-3,5-dibenzoyloxy-4-[(2s)-3-cyclohexyl-1-oxo-1-phenylmethoxypropan-2-yl]oxy-6-ethylsulfanyloxan-2-yl]methyl benzoate (CHEM352690)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-09-01 03:32:35 UTC | ||||||||
| Update Date | 2026-09-01 03:32:35 UTC | ||||||||
| Accession Number | CHEM352690 | ||||||||
| Identification | |||||||||
| Common Name | [(2r,3s,4s,5r,6s)-3,5-dibenzoyloxy-4-[(2s)-3-cyclohexyl-1-oxo-1-phenylmethoxypropan-2-yl]oxy-6-ethylsulfanyloxan-2-yl]methyl benzoate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C45H48O10S | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 780.297 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | Not Available | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCSC1C(C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(CC4CCCCC4)C(=O)OCC5=CC=CC=C5)OC(=O)C6=CC=CC=C6 | ||||||||
| InChI Identifier | InChI=1S/C45H48O10S/c1-2-56-45-40(55-43(48)35-26-16-7-17-27-35)39(52-36(28-31-18-8-3-9-19-31)44(49)50-29-32-20-10-4-11-21-32)38(54-42(47)34-24-14-6-15-25-34)37(53-45)30-51-41(46)33-22-12-5-13-23-33/h4-7,10-17,20-27,31,36-40,45H,2-3,8-9,18-19,28-30H2,1H3/t36-,37+,38-,39-,40+,45-/m0/s1 | ||||||||
| InChI Key | YYYMOUZAOSPUSU-CAYOQFSESA-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 |
| ||||||||
| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra | |||||||||
| 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 | ||||||||
