(3S,3aR,4aS,8aR,9aR)-3,8a-dimethyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one
Modify Date: 2025-08-25 18:57:29
![(3S,3aR,4aS,8aR,9aR)-3,8a-dimethyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one Structure](https://image.chemsrc.com/caspic/101/1856-58-2.png)
(3S,3aR,4aS,8aR,9aR)-3,8a-dimethyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one structure
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Common Name | (3S,3aR,4aS,8aR,9aR)-3,8a-dimethyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one | ||
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| CAS Number | 1856-58-2 | Molecular Weight | 234.33400 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C15H22O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | (3S,3aR,4aS,8aR,9aR)-3,8a-dimethyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one |
|---|---|
| Synonym | More Synonyms |
| Molecular Formula | C15H22O2 |
|---|---|
| Molecular Weight | 234.33400 |
| Exact Mass | 234.16200 |
| PSA | 26.30000 |
| LogP | 3.32050 |
| Vapour Pressure | 3.26E-05mmHg at 25°C |
| InChIKey | YYJRTJYCOMIDIC-GGAZOKNXSA-N |
| SMILES | C=C1CCCC2(C)CC3OC(=O)C(C)C3CC12 |
| Precursor 0 | |
|---|---|
| DownStream 1 | |
CAS#:470-17-7|
Name: Antiproliferative activity against human HT1080 cells assessed as inhibition of cell ...
Source: ChEMBL
Target: HT-1080
External Id: CHEMBL2342225
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Name: Toxicity in Salmonella Typhimurium TA98 at 300 ug/plate in presence of liver S9 fract...
Source: ChEMBL
Target: Salmonella enterica subsp. enterica serovar Typhimurium
External Id: CHEMBL961891
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Name: Inhibition of NLRP3 inflammasome activation in LPS-activated human THP-1 cells assess...
Source: ChEMBL
Target: NACHT, LRR and PYD domains-containing protein 3
External Id: CHEMBL5549262
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|
Name: Antiproliferative activity against human A549 cells assessed as inhibition of cell pr...
Source: ChEMBL
Target: A549
External Id: CHEMBL2342227
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|
Name: Inhibition of NLRP3 inflammasome activation in LPS-activated human THP-1 cells assess...
Source: ChEMBL
Target: NACHT, LRR and PYD domains-containing protein 3
External Id: CHEMBL5549263
|
|
Name: Toxicity in Salmonella Typhimurium TA98 at 150 ug/plate in presence of liver S9 fract...
Source: ChEMBL
Target: Salmonella enterica subsp. enterica serovar Typhimurium
External Id: CHEMBL961892
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|
Name: Antiproliferative activity against human HepG2 cells assessed as inhibition of cell p...
Source: ChEMBL
Target: HepG2
External Id: CHEMBL2342226
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| Dihydroisoalantolactone |
| 11,13-Dihydroisoalantolactone |