Cas no 65967-01-3 (n-acetylcolchinol methyl ether)
65967-01-3 structure
Product Name:n-acetylcolchinol methyl ether
CAS No:65967-01-3
MF:C21H25NO5
MW:371.426906347275
CID:863478
PubChem ID:97866
Update Time:2025-04-19
n-acetylcolchinol methyl ether Chemical and Physical Properties
Names and Identifiers
-
- n-acetylcolchinol methyl ether
- N-(1,2,3,9-tetramethoxy-6,7-dihydro-5H-dibenzo[5,3-b:1',2'-e][7]annulen-7-yl)acetamide
- Acetamide, N-(6,7-dihydro-3,9,10,11-tetramethoxy-5H-dibenzo(a,c)cyclohepten-5-yl)-, (S)-
- Colchinol, N-acetyl-, methyl ether
- SKF 287
-
- Inchi： 1S/C21H25NO5/c1-12(23)22-17-9-6-13-10-18(25-3)20(26-4)21(27-5)19(13)15-8-7-14(24-2)11-16(15)17/h7-8,10-11,17H,6,9H2,1-5H3,(H,22,23)
- InChI Key： FEPNCXXZWLXIHV-UHFFFAOYSA-N
- SMILES： O(C)C1=C(C(=CC2=C1C1C=CC(=CC=1C(CC2)NC(C)=O)OC)OC)OC
Computed Properties
- Exact Mass: 371.17335
- Monoisotopic Mass: 371.17327290g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 27
- Rotatable Bond Count: 5
- Complexity: 501
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 66?2
Experimental Properties
- PSA: 66.02
n-acetylcolchinol methyl ether Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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2. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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