[(3r,3as,7e,7as)-7-[(2z)-2-[(5s)-5-hydroxy-2-methylidenecyclohexylidene]ethylidene]-3-[(2r)-6-methylheptan-2-yl]-2,3,4,5,6,7a-hexahydro-1h-inden-3a-yl]methyl acetate (CHEM345843)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 14:46:00 UTC | ||||||||
| Update Date | 2026-08-31 14:46:00 UTC | ||||||||
| Accession Number | CHEM345843 | ||||||||
| Identification | |||||||||
| Common Name | [(3r,3as,7e,7as)-7-[(2z)-2-[(5s)-5-hydroxy-2-methylidenecyclohexylidene]ethylidene]-3-[(2r)-6-methylheptan-2-yl]-2,3,4,5,6,7a-hexahydro-1h-inden-3a-yl]methyl acetate | ||||||||
| Class | Small Molecule | ||||||||
| Description | [(3r,3as,7e,7as)-7-[(2z)-2-[(5s)-5-hydroxy-2-methylidenecyclohexylidene]ethylidene]-3-[(2r)-6-methylheptan-2-yl]-2,3,4,5,6,7a-hexahydro-1h-inden-3a-yl]methyl acetate is a chemical compound with the formula C29H46O3. It has an average molecular weight of 442.70 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C29H46O3 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 442.345 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | [(3r,3as,7e,7as)-7-[(2z)-2-[(5s)-5-hydroxy-2-methylidenecyclohexylidene]ethylidene]-3-[(2r)-6-methylheptan-2-yl]-2,3,4,5,6,7a-hexahydro-1h-inden-3a-yl]methyl acetate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)COC(=O)C | ||||||||
| InChI Identifier | InChI=1S/C29H46O3/c1-20(2)8-6-9-22(4)27-15-16-28-24(10-7-17-29(27,28)19-32-23(5)30)12-13-25-18-26(31)14-11-21(25)3/h12-13,20,22,26-28,31H,3,6-11,14-19H2,1-2,4-5H3/b24-12+,25-13-/t22-,26+,27-,28+,29+/m1/s1 | ||||||||
| InChI Key | GKWGCITYEOHSED-HKCRWRSOSA-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 | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
