Cas no 72362-21-1 (Pukeleimid E)
Pukeleimid E structure
Product Name:Pukeleimid E
CAS No:72362-21-1
MF:C13H14N2O4
MW:262.261263370514
CID:2015228
PubChem ID:23247771
Update Time:2025-04-21
Pukeleimid E Chemical and Physical Properties
Names and Identifiers
-
- Pukeleimid E
- Pukeleimide E
- 1,5-Dihydro-4-methoxy-1-[[(E)-1-methyl-4-methylene-5-oxopyrrolidin-2-ylidene]acetyl]-2H-pyrrol-2-one
- CHEBI:199181
- 72362-21-1
- (5E)-5-[2-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-2-oxoethylidene]-1-methyl-3-methylidenepyrrolidin-2-one
- DTXSID301046115
- (5E)-5-(2-(3-methoxy-5-oxo-2H-pyrrol-1-yl)-2-oxoethylidene)-1-methyl-3-methylidenepyrrolidin-2-one
-
- Inchi： 1S/C13H14N2O4/c1-8-4-9(14(2)13(8)18)5-11(16)15-7-10(19-3)6-12(15)17/h5-6H,1,4,7H2,2-3H3/b9-5+
- InChI Key： PKYAOXMLUVFBOB-WEVVVXLNSA-N
- SMILES： O(C)C1=CC(N(C(/C=C2\CC(=C)C(N\2C)=O)=O)C1)=O
Computed Properties
- Exact Mass: 262.09535693g/mol
- Monoisotopic Mass: 262.09535693g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 545
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.5
- Topological Polar Surface Area: 66.9?2
Pukeleimid E Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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