• Title/Summary/Keyword: HMBC

Search Result 158, Processing Time 0.03 seconds

Preliminary Structure Determination of the theonellapeptolide Ie from the marine sponge Theonella swinhoei Using NMR Methods

  • Oh, Sun-Kwan;Kim, Eun-Hee;Cheong, Hae-Kap;Rho, Jung-Rae
    • Journal of the Korean Magnetic Resonance Society
    • /
    • v.10 no.2
    • /
    • pp.188-196
    • /
    • 2006
  • A known theonellapeptolide Ie, previously reported in other research group, was isolated from the methanolic extract of the Philippine sponge Theonella swinhoei. The planar structure of this compound was determined on the basis of NMR methods including HMBC and selective HMBC experiments. This is fast and efficient for the dereplication of natural products compared with the MS studies of fragments obtained from complete and partial hydrolysis. The sequence of thirteen amino acids including six N-methyl amino acids in the compound was clearly determined from correlations of extensive HMBC experiments.

  • PDF

NMR assignments including HMBC and 1D-TOCSY data of Astragaloside I, II and Isoastragaloside I from the Roots of Astragalus membranaceus (황기뿌리에서 분리한 Astragaloside I, II 및 Isoastragaloside I의 HMBC와 1D-TOCSY data를 포함한 nmr assignments)

  • Park, Jin-Seo;Kim, Chung-Sook;Kim, Jong-Moon;Kim, Jin-Sook
    • Korean Journal of Pharmacognosy
    • /
    • v.31 no.1
    • /
    • pp.34-38
    • /
    • 2000
  • Three compounds were isolated from the roots of Astragalus membranaceus (Leguminosae). On the basis of spectroscopic evidences, the structures were characterized as $3-0-{\beta}-D-xylopyranosyl-(2',3'-O-diacetyl)-6-0-{\beta}-D-glucopyranosyl-3{\beta},6{\alpha},16{\beta},25-tetrahydroxy-20(R)$,24(S)-epoxy-cycloartane(Astragaloside I), $3-0-{\beta}-D-xylopyranosyl-(2'-O-acetyl)-6-0-{\beta}-D-glucopyranosyl-3{\beta},6{\alpha},16{\beta},25-tetrahydroxy-20(R)$,24(S)-epoxy-cycloartane(Astragaloside II), $3-0-{\beta}-D-xylopyranosyl-(2',4'-O-diacetyl)-6-0-{\beta}-D-glucopyranosyl-3{\beta},6{\alpha},16{\beta},25-tetrahydroxy-20(R)$,24(S)-epoxycycloartane(Isoastragaloside I). Full data of NMR including HMBC and 1D-TOCSY experiment of these compounds were reported for the first time.

  • PDF

A Study on the Constituents from the Roots of Polygala tenuifolia (원지뿌리의 성분연구)

  • Park, Jin-Sea;Kim, Ki-Young;Doh, Sang-Hak;Kim, Jin-Sook
    • Korean Journal of Pharmacognosy
    • /
    • v.30 no.4
    • /
    • pp.417-419
    • /
    • 1999
  • $Three\;compounds-ethyl-{\beta}-D-glucopyranoside$, 1,2,3,7-tetramethoxyxanthone, 1,7-dimethoxyxanthone-were isolated from roots of Polygala tenuifolia. The structures of these compounds were establised on the basis of spectral evidence including 2D NMR and HMBC studies. $Ethyl-{\beta}-D-glucopyranoside$ was isolated for the first time from Polygala genus and HMBC data of these compounds were first reported.

  • PDF

The NMR assignments of anthraquinones from Cassia tora

  • Choi, Jae-Sue;Jung, Jee-Hyung;Lee, Hee-Jung;Kang, Sam-Sik
    • Archives of Pharmacal Research
    • /
    • v.19 no.4
    • /
    • pp.302-306
    • /
    • 1996
  • The $^1H- and^{13}C-NMR$ spectra of alaternin, aurantio-obtusin, chryso-obtusin, obtusin and 2-glucosyl obtusifolin isolated from the seeds of Cassia tora have been assigned based on HMBC, long-range HETCOR, fully $^1H-coupled {13}^C-NMR$, deuterium isotope experiment, and by comparison with the model compounds.

  • PDF

The NMR Assignments of Torilin from Torilis japonica

  • Kang, Sam-Sik;Lee, Eun-Bang;Kim, Tae-Hee;Kim, Kyung-Ran;Jung, Jee-Hyung
    • Archives of Pharmacal Research
    • /
    • v.17 no.4
    • /
    • pp.284-286
    • /
    • 1994
  • A guaian type sesquiterpene, torilin, was isolated from the hexane extract of the fruits of Torilis japonica. The $^1H{\;}and{\;}^{13}C-sinals$ of this compound have been fully assigned utilizing $^1H-^1H$ COSY, HMQC, and HMBC experiments.

  • PDF

Complete Assignment of $^{1}H$ and $^{13}C$-NMR Signals for (20S) and (20R)-Protopanaxadiol by 2D-NMR Techniques (2D-NMR 기법을 이용한 (20S)와 (20R)-Protopanaxadiol의 $^{1}H$- 및 $^{13}C$-NMR 완전 동정)

  • 백남인;김동선
    • Journal of Ginseng Research
    • /
    • v.19 no.1
    • /
    • pp.45-50
    • /
    • 1995
  • (20S)- and (20R)-protopanaxadiol were prepared from crude ginseng saponin by chemical treatment. The $^{1}H$- and $^{13}C$-NMR signals of these compounds were fully assigned by various NMR techniques such as DEPT, 1H-1H COSY, HMQC, HMBC and NOESY.

  • PDF

Studies on Chemical Structure Determination of Polygonatum sibiricum Extracts(I) (황정(黃精) 추출물의 화학구조 결정에 관한 연구(I))

  • 신동수;윤중호;박주희;권기락;안철진;주우홍;강진호;문병호
    • Journal of Life Science
    • /
    • v.9 no.2
    • /
    • pp.207-211
    • /
    • 1999
  • Biologically active compounds in Polygonatum sibiricum were extracted using organic solvents as hexane, CHCl$_3$, n-butanol corresponding each component. Compound I was purified from hexane layer and the chemical structure of compound I was characterized using 1H-NMR, 13C-NMR, DEPT135, COSY, HMQC, HMBC spectrum and MS-spectrum. Consequently, the chemical structure of compound I was determined as 9,12-(9E,l2E)-octade cadienoic acid.

  • PDF

Studies on Chemical Structure Determination of Polygonatum sibiricum Extracts(II) (황정(黃精) 추출물의 화학구조 결정에 관한 연구(II))

  • 신동수;김흥재;조수동;권기락;안철진;주우홍;강진호;문병호
    • Journal of Life Science
    • /
    • v.9 no.2
    • /
    • pp.212-215
    • /
    • 1999
  • Biologically active compounds in Polygonatum sibiricum were extracted using organic solvents as hexane, CHC1$_3$, n-butanol corresponding each component. Compound II was purified from hexane layer and the chemical structure of compound II was characterized using IH-nmr, 13C-nmr, DEPT135, COSY, HMQC, HMBC spectrum and MS-spectrum. Consequently, the chemical structure of compound II was determined as 2-Hydroxy-3-(9,12-(9E,12E)-Octadecadienoyloxy) propanoic acid.

  • PDF

Isolation and NMR Assignment of a Pennogenin Glycoside from Dioscorea bulbifera L. var sativa

  • Teponno, Remy Bertrand;Tapondjou, Azefack Leon;Djoukeng, Jules Desire;Abou-Mansour, Eliane;Tabacci, Raphael;Tane, Pierre;Lontsi, David;Park, Hee-Juhn
    • Natural Product Sciences
    • /
    • v.12 no.1
    • /
    • pp.62-66
    • /
    • 2006
  • A steroidal saponin, $3-O-{\alpha}-L-rhamnopyranosyl-(1{\rightarrow}2)-[{\alpha}-L-rhamnopyranosyl-(1{\rightarrow}3)]-{\beta}-D-glucopyranosylpennogenin$ ;(1, spiroconazole A) was isolated from the tubers of Dioscorea bulbifera L. var sativa and $^1H-and\;^{13}C-NMR$ assignment was completed using HMBC correlation. In addition, four phenolic substances, 2,7-dihydroxy-4-methoxyphenanthrene (2), quercetin (3), $quercetin-3-O-{\beta}-D-glucopyranoside$ (4), and $quercetin-3-O-{\beta}-D-galactopyranoside$ (5) were also isolated.

The Chemical Constituents from Unidentified Sponge (해면의 화학적 성분 연구)

  • Park, Seon Gu;Paul J. Scheuer
    • Journal of the Korean Chemical Society
    • /
    • v.38 no.2
    • /
    • pp.169-173
    • /
    • 1994
  • The previously reported cytotoxic metabolites, against the KB cell line, xestoquinone, halenaquinol sulfate and $halenaquinol^{5,6}$ were isolated from the unidentified sponge collected in October 1992, Manado Bay, Sulawesi in Indonesia. Their structure were elucidated by $^1H-,\;^{13}C$-NMR, $^1H-,\;^{13}C$(1 bond) Heteronuclear Multiple Quantum Coherence Spectroscopy$(HMQC)^1$, $^1H-,\;^{13}C$C(2 and 3 bond) Heteronuclear multiple Bond Correlation Spectroscopy$(HMBC)^2$, Electron Impact Mass Spectroscopy(EI ms), Ultraviolet Spectroscopy(UV), and Infrared Spectroscopy(IR)

  • PDF