Cas no 546-97-4 (Columbin)
Columbin structure
Product Name:Columbin
Columbin Chemical and Physical Properties
Names and Identifiers
-
- Columbin
- (1R,4R,4aR,6aR,9S,10aS,10bS)-9-(3-Furanyl)-1,4,4a,5,6,6a,9,10,10a,10b-decahydro-4-hydroxy-4a,10a-dimethyl-1,4-etheno-3H,7H-benzo[1,2-c:3,4-c']dipyran-3,7-dione
- (1S,2R,3S,5S,8S,11R,12S)-5-(Furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.0
- ISOCOLUMBIN
- (3S,11R,12S)-5-(furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-
- 15,16-Epoxy-4-hydroxy-2,13(16),14-clerodatriene-17,12:18,1-diolide; (1β,4α,5α,8βH,12αH)-form
- CHEBI:3829
- HY-N0389
- 2-(Furan-3-yl)-7-hydroxy-6a,10b-dimethyl-1,2,4a,5,6,6a,7,10,10a,10b-decahydro-4H-10,7-(epoxymethano)naphtho[2,1-c]pyran-4,12-dione
- CS-6235
- (2S,4AR,6aR,7R,10R,10aS,10bS)-2-(furan-3-yl)-7-hydroxy-6a,10b-dimethyl-4a,5,6,6a,7,10,10a,10b-octahydro-1H-10,7-(epoxymethano)benzo[f]isochromene-4,12(2H)-dione
- C09077
- DTXSID70969857
- AS-82882
- 546-97-4
- AC-34240
- Columbin, >=95% (LC/MS-ELSD)
- (1R,2S,3S,5S,8R,11R,12R)-5-(Furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-ene-7,13-dione
- Q27106207
- SCHEMBL2153783
- AKOS030573585
-
- MDL: MFCD02682955
- Inchi: 1S/C20H22O6/c1-18-9-14(11-5-8-24-10-11)25-16(21)12(18)3-6-19(2)15(18)13-4-7-20(19,23)17(22)26-13/h4-5,7-8,10,12-15,23H,3,6,9H2,1-2H3/t12-,13+,14-,15-,18+,19+,20-/m0/s1
- InChI Key: AALLCALQGXXWNA-QJNFORGASA-N
- SMILES: O1C([C@]2(C=C[C@@H]1[C@H]1[C@]3(C)C[C@@H](C4=COC=C4)OC([C@@H]3CC[C@]12C)=O)O)=O
Computed Properties
- Exact Mass: 358.14200
- Monoisotopic Mass: 358.14163842 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 1
- Complexity: 702
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 86
- Molecular Weight: 358.4
Experimental Properties
- Color/Form: Powder
- Density: 1.36
- Melting Point: 190-191 oC
- Boiling Point: 410.82°C (rough estimate)
- Flash Point: 296.0±30.1 °C
- Refractive Index: 1.4450 (estimate)
- PSA: 85.97000
- LogP: 2.53270
- Specific Rotation: D +52.5° (pyridine)
- Vapor Pressure: 0.0±1.6 mmHg at 25°C
Columbin Security Information
- Signal Word:warning
- Hazard Statement: H303+H313+H333
- Warning Statement: P264+P280+P305+P351+P338+P337+P313
- Safety Instruction: H303+H313+H333
- Storage Condition:Powder -20°C 3 years ? 4°C 2 years In solvent -80°C 6 months ? -20°C 1 month
Columbin Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| MedChemExpress | HY-N0389-10mM*1mLinDMSO |
Columbin |
546-97-4 | 99.77% | 10mM*1mLinDMSO |
¥550 | 2023-07-26 | |
| MedChemExpress | HY-N0389-5mg |
Columbin |
546-97-4 | 99.86% | 5mg |
¥400 | 2025-04-16 | |
| MedChemExpress | HY-N0389-10mg |
Columbin |
546-97-4 | 99.86% | 10mg |
¥650 | 2025-04-16 | |
| MedChemExpress | HY-N0389-25mg |
Columbin |
546-97-4 | 99.77% | 25mg |
¥1600 | 2023-08-31 | |
| MedChemExpress | HY-N0389-50mg |
Columbin |
546-97-4 | 99.77% | 50mg |
¥2800 | 2023-08-31 | |
| ChemFaces | CFN90480-20mg |
Columbin |
546-97-4 | >=98% | 20mg |
$158 | 2021-07-22 | |
| ChemScence | CS-6235-5mg |
Columbin |
546-97-4 | 98.86% | 5mg |
$60.0 | 2022-04-27 | |
| ChemScence | CS-6235-10mg |
Columbin |
546-97-4 | 98.86% | 10mg |
$96.0 | 2022-04-27 | |
| ChemScence | CS-6235-25mg |
Columbin |
546-97-4 | 98.86% | 25mg |
$192.0 | 2022-04-27 | |
| ChemScence | CS-6235-50mg |
Columbin |
546-97-4 | 98.86% | 50mg |
$336.0 | 2022-04-27 |
Columbin Suppliers
Amadis Chemical Company Limited
Gold Member
(CAS:546-97-4)Columbin
Order Number:A1203952
Stock Status:in Stock
Quantity:50mg/100mg
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 02:51
Price ($):165.0/246.0
Email:[email protected]
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
(CAS:546-97-4)Columbin
Order Number:LE1227
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 11:40
Price ($):discuss personally
Email:[email protected]
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
(CAS:546-97-4)Columbin
Order Number:CRN0175
Stock Status:in stock
Quantity:5mg/20mg/50mg
Purity:≥98%
Pricing Information Last Updated:Friday, 14 March 2025 10:55
Price ($):
Email:[email protected]
Columbin Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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