Determine the necessary mass, volume, or concentration for preparing a solution.
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Basic Description
| Synonyms | ABIETIC ACID|514-10-3|Sylvic acid|Abietate|l-Abietic acid|Rosin Acid|7,13-Abietadien-18-oic acid|Kyselina abietova|13-Isopropylpodocarpa-7,13-dien-15-oic acid|CCRIS 3183|Abietic acid, technical|Abietinic acid|EINECS 208-178-3|NSC 25149|UNII-V3DHX33184|(-) |
|---|---|
| Specifications & Purity | 10mM in DMSO |
| Storage Temp | Protected from light,Store at -80°C |
| Shipped In | Ice chest + Ice pads |
| Product Description | Starting material for natural product synthesis. Epoxidation with MCPBA. |
Associated Targets
EHMT2 Tchem Histone-lysine N-methyltransferase EHMT2 0 Activities
RARG Tclin Retinoic acid receptor gamma 0 Activities
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VDR Tclin Vitamin D3 receptor 0 Activities
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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 0 Activities
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SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 0 Activities
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PDK3 Tchem [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 3, mitochondrial 0 Activities
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RARA Tclin Retinoic acid receptor alpha 0 Activities
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PTGS2 Tclin Prostaglandin G/H synthase 2 0 Activities
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LMNA Tbio Prelamin-A/C 0 Activities
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NR1H3 Tchem Oxysterols receptor LXR-alpha 0 Activities
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GLS Tchem Glutaminase kidney isoform, mitochondrial 0 Activities
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PPARD Tchem Peroxisome proliferator-activated receptor delta 0 Activities
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PPARG Tclin Peroxisome proliferator-activated receptor gamma 0 Activities
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Names and Identifiers
| IUPAC Name | (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid |
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| INCHI | InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1 |
| InChi Key | RSWGJHLUYNHPMX-ONCXSQPRSA-N |
| Canonical SMILES | CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)O)C |
| Isomeric SMILES | CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)O)C |
| WGK Germany | 3 |
| RTECS | TP8580000 |
| PubChem CID | 10569 |
| Molecular Weight | 302.45 |
| Beilstein | 2221451 |
| Reaxy-Rn | 2221451 |
Certificates
Certificate of Analysis(COA)
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Chemical and Physical Properties
| Sensitivity | moisture & air&Light sensitive |
|---|---|
| Specific Rotation[α] | [α]20/D −85±10°, c = 1% in ethanol |
| Melt Point(°C) | 150-165 °C |
Safety and Hazards(GHS)
| Pictogram(s) | GHS09, GHS07 |
|---|---|
| Signal | Warning |
| Hazard Statements | H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation H400:Very toxic to aquatic life H410:Very toxic to aquatic life with long lasting effects |
| Precautionary Statements | P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P391:Collect spillage. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell. |
| WGK Germany | 3 |
| RTECS | TP8580000 |
| Reaxy-Rn | 2221451 |
| Merck Index | 7 |