Cas no 4029-69-0 (3-O-acetylbufotalin)
3-O-acetylbufotalin structure
Product Name:3-O-acetylbufotalin
3-O-acetylbufotalin Chemical and Physical Properties
Names and Identifiers
-
- Bufotalin 3-acetate
- 3-O-acetylbufotalin
- a-hydroxy-
- digitoxigenin rhamnoside
- DIGITOXIGENIN-3-O-A-L-RHAMNOPYRANOSIDE
- DIGITOXIGENIN-3-O-RHAMNOSIDE
- digitoxigenin3-rhamnoside
- Digitoxigenine-3-rhamnoside
- evomonosid
- EVOMONOSIDE(RG)(CALL)
- NSC135689
- NCI60_000798
- 3,16-Bis(acetyloxy)-14-hydroxybufa-20,22-dienolide
- [3-acetyloxy-14-hydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] acetate
- DTXSID90960725
- Bufa-20, 3,16-bis(acetyloxy)-14-hydroxy-, (3.beta.,5.beta.,16.beta.)-
- PD125035
- [16-acetyloxy-14-hydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
- 4029-69-0
- DA-48923
- 5.beta.-Bufa-20, 3.beta.,14,16.beta.-trihydroxy-, 3,16-diacetate
-
- Inchi： 1S/C28H38O7/c1-16(29)34-20-9-11-26(3)19(13-20)6-7-22-21(26)10-12-27(4)25(18-5-8-24(31)33-15-18)23(35-17(2)30)14-28(22,27)32/h5,8,15,19-23,25,32H,6-7,9-14H2,1-4H3
- InChI Key： NHHVQEFHQTULER-UHFFFAOYSA-N
- SMILES： O([H])C12C([H])([H])C([H])(C([H])(C3=C([H])OC(C([H])=C3[H])=O)C1(C([H])([H])[H])C([H])([H])C([H])([H])C1([H])C3(C([H])([H])[H])C([H])([H])C([H])([H])C([H])(C([H])([H])C3([H])C([H])([H])C([H])([H])C21[H])OC(C([H])([H])[H])=O)OC(C([H])([H])[H])=O
Computed Properties
- Exact Mass: 486.26175355 g/mol
- Monoisotopic Mass: 486.26175355 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 35
- Rotatable Bond Count: 5
- Complexity: 984
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 9
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 486.6
- XLogP3: 3.1
- Topological Polar Surface Area: 99.1
Experimental Properties
- Color/Form: Solid
- Density: 1.2±0.1 g/cm3
- Boiling Point: 596.6±50.0 °C at 760 mmHg
- Flash Point: 191.9±23.6 °C
- Vapor Pressure: 0.0±3.8 mmHg at 25°C
3-O-acetylbufotalin Security Information
- Signal Word：warning
- Hazard Statement： H303 may be harmful by ingestion +h313 may be harmful by skin contact +h2413 may be harmful by inhalation
-
Warning Statement：
P264 wash thoroughly after treatment
p280 wear protective gloves / wear protective clothing / wear protective eye masks / wear protective masks
p305 if in eyes
p351 rinse carefully with water for a few minutes
p338 remove contact lenses (if any) and easy to operate, continue rinsing
p337 if eye irritation persists
p2393 get medical advice / care - Safety Instruction： H303 may be harmful by ingestion +h313 may be harmful by skin contact +h2413 may be harmful by inhalation
- Storage Condition：Please store the product under the recommended condition sin the description
3-O-acetylbufotalin Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chengdu Biopurify Phytochemicals Ltd | BP2069-20mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 20mg |
$270 | 2023-09-20 | |
| Chengdu Biopurify Phytochemicals Ltd | BP2069-5mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 5mg |
$96 | 2023-09-20 | |
| Chengdu Biopurify Phytochemicals Ltd | BP2069-10mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 10mg |
$160 | 2023-09-20 | |
| WU HAN AN JIE KAI Biomedical Technology Co., Ltd. | ajce54476-1mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 1mg |
￥0.00 | 2023-09-07 | |
| WU HAN AN JIE KAI Biomedical Technology Co., Ltd. | ajce54476-5mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 5mg |
￥0.00 | 2023-09-07 | |
| MedChemExpress | HY-N6898-5mg |
3-O-Acetylbufotalin |
4029-69-0 | 5mg |
￥4030 | 2022-09-01 | ||
| MedChemExpress | HY-N6898-10mg |
3-O-Acetylbufotalin |
4029-69-0 | 10mg |
￥6860 | 2022-09-01 | ||
| Chengdu Biopurify Phytochemicals Ltd | BP2069-20mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 20mg |
$270 | 2023-09-19 | |
| Chengdu Biopurify Phytochemicals Ltd | BP2069-5mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 5mg |
$96 | 2023-09-19 | |
| Chengdu Biopurify Phytochemicals Ltd | BP2069-10mg |
3-O-Acetylbufotalin |
4029-69-0 | 98% | 10mg |
$160 | 2023-09-19 |
3-O-acetylbufotalin Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Steroid lactones Bufanolides and derivatives
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Bufanolides and derivatives
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