Totarol
Totarol structure
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Common Name | Totarol | ||
|---|---|---|---|---|
| CAS Number | 511-15-9 | Molecular Weight | 284.479 | |
| Density | 0.9±0.1 g/cm3 | Boiling Point | 346.1±37.0 °C at 760 mmHg | |
| Molecular Formula | C20H30O | Melting Point | 128-132ºC(lit.) | |
| MSDS | N/A | Flash Point | 163.0±15.1 °C | |
Use of Totarol(+)-Totarol is a diterpenoid compound isolated from Podocarpus spp.. (+)-Totarol is a potent antioxidant and antibacterial agent[1]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Totarol |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | (+)-Totarol is a diterpenoid compound isolated from Podocarpus spp.. (+)-Totarol is a potent antioxidant and antibacterial agent[1]. |
|---|---|
| Related Catalog | |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 346.1±37.0 °C at 760 mmHg |
| Melting Point | 128-132ºC(lit.) |
| Molecular Formula | C20H30O |
| Molecular Weight | 284.479 |
| Flash Point | 163.0±15.1 °C |
| Exact Mass | 284.250397 |
| PSA | 20.23000 |
| LogP | 8.76 |
| Vapour Pressure | 0.0±0.4 mmHg at 25°C |
| Index of Refraction | 1.513 |
| InChIKey | ZRVDANDJSTYELM-FXAWDEMLSA-N |
| SMILES | CC(C)c1c(O)ccc2c1CCC1C(C)(C)CCCC21C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 3 | |
CAS#:6755-93-7
CAS#:641636-79-5
CAS#:102867-67-4
CAS#:843664-19-7
CAS#:843663-91-2
CAS#:843663-94-5
CAS#:843663-93-4
CAS#:74-98-6
CAS#:832-69-9
CAS#:111589-12-9This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: Antimicrobial activity against Staphylococcus aureus 1199B expressing NorA pump
Source: ChEMBL
Target: Staphylococcus aureus
External Id: CHEMBL955404
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Name: Primary qHTS assay for small molecule inhibitors of Inositol hexaphosphate kinase 1 (...
Source: NCGC
External Id: IP6K1-p1
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Inhibition of NorA efflux pump in Staphylococcus aureus 1199B assessed as reduction i...
Source: ChEMBL
Target: Quinolone resistance protein NorA
External Id: CHEMBL955401
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Name: ERK5 transcriptional activity HTS
Source: 24565
Target: N/A
External Id: ERK5 transcriptional activity-HTS
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: Ratio of inhibition of CHO cells to IC50 for chloroquine-resistant Plasmodium falcipa...
Source: ChEMBL
Target: N/A
External Id: CHEMBL955403
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Name: Inhibition of NorA efflux pump in Staphylococcus aureus K3092 assessed as reduction i...
Source: ChEMBL
Target: Quinolone resistance protein NorA
External Id: CHEMBL955402
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 14-Isopropylpodocarpa-8,11,13-trien-13-ol |
| 4b-S-trans-8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydro-1-isopropylphenanthren-2-ol |
| 14-Isopropyl-13-methylpodocarpa-8,11,13-triene |
| 2-PHENANTHRENOL,4B,5,6,7,8,8A |
| trans-Totarol |
| 4BS TRANS,8,8-TRIMETHYL4B,5,6,7,8,8A,9,1 |
| Podocarpa-8,11,13-trien-13-ol,14-isopropyl |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of Totarol? |
| A: CAS number of Totarol is 511-15-9. |
| Q: What is the molecular formula of Totarol? |
| A: Molecular formula of Totarol is C20H30O. |
| Q: What are the downstream products of Totarol? |
| A: Related downstream products(CAS) of Totarol: 74-98-6;832-69-9;111589-12-9. |
| Q: What is the melting point of Totarol? |
| A: Melting point of Totarol is 128-132ºC(lit.). |
| Q: What are the upstream materials of Totarol? |
| A: Related upstream materials(CAS) of Totarol: 6755-93-7;641636-79-5;102867-67-4;843664-19-7;843663-91-2;843663-94-5;843663-93-4. |
| Q: What is the InChIKey of Totarol? |
| A: InChIKey of Totarol is ZRVDANDJSTYELM-FXAWDEMLSA-N. |
| Q: What is the LogP of Totarol? |
| A: LogP of Totarol is 8.76. |
| Q: What is the SMILES notation of Totarol? |
| A: SMILES notation of Totarol is CC(C)c1c(O)ccc2c1CCC1C(C)(C)CCCC21C. |
| Q: What English synonyms does Totarol have? |
| A: English synonyms of Totarol: 14-Isopropylpodocarpa-8,11,13-trien-13-ol, 4b-S-trans-8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydro-1-isopropylphenanthren-2-ol, 14-Isopropyl-13-methylpodocarpa-8,11,13-triene, 2-PHENANTHRENOL,4B,5,6,7,8,8A, trans-Totarol, 4BS TRANS,8,8-TRIMETHYL4B,5,6,7,8,8A,9,1, Podocarpa-8,11,13-trien-13-ol,14-isopropyl. |
| Q: What is the English name of Totarol? |
| A: The English name of Totarol is Totarol. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| BioBioPha |
| naturewill |