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PRESINULAROLIDE_B
SpectraBase Compound ID 9l7OjcVwjUb
InChI InChI=1S/C20H28O4/c1-13-6-4-8-14(2)18(22)19-17(15(3)20(23)24-19)11-10-16(12-21)9-5-7-13/h7-8,10,17-19,21-22H,3-6,9,11-12H2,1-2H3/b13-7+,14-8+,16-10-/t17-,18-,19-/m1/s1
InChIKey IAWHPIHHKZYGDC-WTDAPOCQSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LUC98bBAT95
Name PRESINULAROLIDE_B
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-13-6-4-8-14(2)18(22)19-17(15(3)20(23)24-19)11-10-16(12-21)9-5-7-13/h7-8,10,17-19,21-22H,3-6,9,11-12H2,1-2H3/b13-7+,14-8+,16-10-/t17-,18-,19-/m1/s1
InChIKey IAWHPIHHKZYGDC-WTDAPOCQSA-N
Literature Reference Author W.ZHANG,K.KROHN,J.DING,Z.H.MIAO,X.H.ZHOU,S.H.CHEN,G.PESCITEL LI,P.SALVADORI,T.KUR
Literature Reference Citation J.NAT.PROD.,71,961(2008)
Literature Reference DOI 10.1021/np800081p
Molecular Weight 332.440 g/mol
Sample ID 28385
Solvent CDCl3