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1-O-(CIS,CIS-9,12-OCTADECADIENOYL)-3-O-(CIS-9-OCTADECENOYL)-GLYCEROL
SpectraBase Compound ID HNjiunLQ1Ky
InChI InChI=1S/C39H70O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17-20,37,40H,3-10,12,14-16,21-36H2,1-2H3/b13-11+,19-17+,20-18+
InChIKey GREDRAMJRDQWEJ-UUDZYBDXSA-N
Mol Weight 619.0 g/mol
Molecular Formula C39H70O5
Exact Mass 618.522325 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4gtGEsfz74s
Name 1-O-(CIS,CIS-9,12-OCTADECADIENOYL)-3-O-(CIS-9-OCTADECENOYL)-GLYCEROL
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H70O5
InChI InChI=1S/C39H70O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17-20,37,40H,3-10,12,14-16,21-36H2,1-2H3/b13-11+,19-17+,20-18+
InChIKey GREDRAMJRDQWEJ-UUDZYBDXSA-N
Literature Reference Author C.Y.MA,W.K.LIU,C.T.CHE
Literature Reference Citation J.NAT.PROD.,65,206(2002)
Literature Reference DOI 10.1021/np010073b
Molecular Weight 618.982 g/mol
Solvent CDCl3
Source File Reference UWSI2819