Beta-Elemonic acid
Beta-Elemonic acid structure
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Common Name | Beta-Elemonic acid | ||
|---|---|---|---|---|
| CAS Number | 28282-25-9 | Molecular Weight | 454.684 | |
| Density | 1.07 | Boiling Point | 565.2±50.0 °C at 760 mmHg | |
| Molecular Formula | C30H46O3 | Melting Point | 216-219 ºC | |
| MSDS | Chinese USA | Flash Point | 309.6±26.6 °C | |
Use of Beta-Elemonic acidβ-Elemonic acid is a triterpene isolated from Boswellia papyrifera. β-Elemonic acid induces cell apoptosis, reactive oxygen species (ROS) and COX-2 expression and inhibits prolyl endopeptidase. β-Elemonic acid exhibits anticancer and anti-inflammatory effects[1][2]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | β-Elemonic acid |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | β-Elemonic acid is a triterpene isolated from Boswellia papyrifera. β-Elemonic acid induces cell apoptosis, reactive oxygen species (ROS) and COX-2 expression and inhibits prolyl endopeptidase. β-Elemonic acid exhibits anticancer and anti-inflammatory effects[1][2]. |
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| Related Catalog | |
| Target |
COX-2 |
| In Vitro | β-elemonic acid (1, 3, 10, 20 µM; 24 hours) strongly induces human A549 lung cancer cell apoptosis in a dose- and time-dependent manner[1]. β-elemonic acid (1, 3, 10, 20 µM; 24 hours) exerts potent cytotoxic effects on human NSCLC A549 cells in a dose-dependent manner. The IC50 value following a 24-h exposure to β-elemonic acid was 6.92 µM[1]. β-elemonic acid (20 µM; 24 hours) results in a cell percentage of 58.01% in the G0/G1 phase[1]. β-elemonic acid (1, 3, 10, 20 µM; 24 hours) inhibits phosphorylation of p42/44, MAPK/JNK and p38 in the A549 cells[1]. |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.07 |
|---|---|
| Boiling Point | 565.2±50.0 °C at 760 mmHg |
| Melting Point | 216-219 ºC |
| Molecular Formula | C30H46O3 |
| Molecular Weight | 454.684 |
| Flash Point | 309.6±26.6 °C |
| Exact Mass | 454.344696 |
| PSA | 54.37000 |
| LogP | 8.56 |
| Vapour Pressure | 0.0±3.3 mmHg at 25°C |
| Index of Refraction | 1.542 |
| InChIKey | XLPAINGDLCDYQV-UHFFFAOYSA-N |
| SMILES | CC(C)=CCCC(C(=O)O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3 |
| Storage condition | -20℃ |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| RIDADR | NONH for all modes of transport |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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Beta-Elemonic acid CAS#:28282-25-9 |
| Literature: Ruzicka et al. Helvetica Chimica Acta, 1943 , vol. 26, p. 1659,1664 |
![(2S)-2-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid structure](https://image.chemsrc.com/caspic/408/82509-40-8.png)
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Cytotoxicity against human CaSKi cells after 6 days by MTT assay
Source: ChEMBL
Target: Ca-Ski
External Id: CHEMBL979628
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Name: Cytotoxicity against human SiHa cells after 6 days by MTT assay
Source: ChEMBL
Target: SiHa
External Id: CHEMBL979627
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Name: Cytotoxicity against human T24 cells after 6 days by MTT assay
Source: ChEMBL
Target: T-24
External Id: CHEMBL979624
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Name: Cytotoxicity against human PLC/PRF/5 cells after 6 days by MTT assay
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL979623
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Name: Cytotoxicity against human HT3 cells after 6 days by MTT assay
Source: ChEMBL
Target: HT-3
External Id: CHEMBL979626
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Name: Cytotoxicity against mouse 212 cells after 6 days by MTT assay
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL979625
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (5β,13α,14β,20S)-3-Oxolanosta-8,24-dien-21-oic acid |
| (2S)-6-methyl-2-[(10S,14S,17S)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-5-enoic acid |
| beta-Elemonic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of β-Elemonic acid? |
| A: Polar surface area (PSA) of β-Elemonic acid is 54.37000. |
| Q: What is the LogP of β-Elemonic acid? |
| A: LogP of β-Elemonic acid is 8.56. |
| Q: What are the uses of β-Elemonic acid? |
| A: Main uses of β-Elemonic acid: β-Elemonic acid is a triterpene isolated from Boswellia papyrifera. β-Elemonic acid induces cell apoptosis, reactive oxygen species (ROS) and COX-2 expression and inhibits prolyl endopeptidase. β-Elemonic acid exhibits anticancer and anti-inflammatory effects[1][2]. |
| Q: What is the English name of β-Elemonic acid? |
| A: The English name of β-Elemonic acid is β-Elemonic acid. |
| Q: What is the molecular formula of β-Elemonic acid? |
| A: Molecular formula of β-Elemonic acid is C30H46O3. |
| Q: What is the melting point of β-Elemonic acid? |
| A: Melting point of β-Elemonic acid is 216-219 ºC. |
| Q: What is the SMILES notation of β-Elemonic acid? |
| A: SMILES notation of β-Elemonic acid is CC(C)=CCCC(C(=O)O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3. |
| Q: What English synonyms does β-Elemonic acid have? |
| A: English synonyms of β-Elemonic acid: (5β,13α,14β,20S)-3-Oxolanosta-8,24-dien-21-oic acid, (2S)-6-methyl-2-[(10S,14S,17S)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-5-enoic acid, beta-Elemonic acid. |
| Q: What is the CAS number of β-Elemonic acid? |
| A: CAS number of β-Elemonic acid is 28282-25-9. |
| Q: What is the molecular weight of β-Elemonic acid? |
| A: Molecular weight of β-Elemonic acid is 454.684. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| naturewill |