Cas no 10159-64-5 (10,11,7'-Trimethoxy-emetan-6'-ol)
10159-64-5 structure
Product Name:10,11,7'-Trimethoxy-emetan-6'-ol
CAS No:10159-64-5
MF:C28H38N2O4
MW:466.612328052521
CID:1997067
PubChem ID:2665
Update Time:2025-04-21
10,11,7'-Trimethoxy-emetan-6'-ol Chemical and Physical Properties
Names and Identifiers
-
- 10,11,7'-Trimethoxy-emetan-6'-ol
- Cephaelin
- cephaeline
- AKOS037514580
- Desmethylemetine
- DTXSID00862004
- Emetan-6'-ol, 7',10,11-trimethoxy-
- FT-0623547
- SCHEMBL13912580
- 10159-64-5
- Cephaelin Hydrochloride
- CHEBI:181712
- 6-Isoquinolinol, 1-[[(2S,3R,11bS)-3-ethyl-1,3,4,6,7,11b?hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizin-2-yl]methyl]-1,2,3,4-tetrahyd
- 1-[(3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methyl]-7-methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol
- (R)-1-(((2S,3R,11bS)-3-Ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-pyrido[2,1-a]isoquinolin-2-yl)methyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol
- DTGZHCFJNDAHEN-UHFFFAOYSA-N
-
- Inchi： 1S/C28H38N2O4/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23/h12-15,17,20,23-24,29,31H,5-11,16H2,1-4H3
- InChI Key： DTGZHCFJNDAHEN-UHFFFAOYSA-N
- SMILES： O(C)C1C(=CC2CCN3CC(CC)C(CC4C5C=C(C(=CC=5CCN4)O)OC)CC3C=2C=1)OC
Computed Properties
- Exact Mass: 466.28315770g/mol
- Monoisotopic Mass: 466.28315770g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 34
- Rotatable Bond Count: 6
- Complexity: 664
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 63.2?2
10,11,7'-Trimethoxy-emetan-6'-ol Related Literature
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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
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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