title: Applications of the improved computerized analysis of 2D INADEQUATE spectra.
abstract: This paper illustrates the use of the program CCBond to determine the carbon skeletons of bioorganic molecules in low concentration samples. Discussed is the structure elucidation of bistramide A, a compound extracted from a Fijian Lissoclinum sp. and cholesterol in 71- and 20-mumol samples, respectively. The detection limit of the automated bond extraction is shown to be dramatically improved compared to the manual interpretation of 2D INADEQUATE spectra.
authors: Department of Chemistry, Medicinal Chemistry, University of Utah, Salt Lake City 84112.
authors: R
authors: R
authors: Dunkel
authors: C L
authors: CL
authors: Mayne
authors: M P
authors: MP
authors: Foster
authors: C M
authors: CM
authors: Ireland
authors: D
authors: D
authors: Li
authors: N L
authors: NL
authors: Owen
authors: R J
authors: RJ
authors: Pugmire
authors: D M
authors: DM
authors: Grant
mesh_terms: D000081:Acetamides; D000970:Antineoplastic Agents / Q000032:analysis; D002247:Carbon Isotopes; D002784:Cholesterol / Q000032:analysis; D004988:Ethers, Cyclic / Q000032:analysis; D009682:Magnetic Resonance Spectroscopy / Q000295:instrumentation*; D008956:Models, Chemical; D011714:Pyrans; D012984:Software; D013141:Spiro Compounds
chemical_list: D000081:Acetamides; D000970:Antineoplastic Agents; D002247:Carbon Isotopes; D004988:Ethers, Cyclic; D011714:Pyrans; D013141:Spiro Compounds; C059975:bistratene A; D002784:Cholesterol