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ARGYINOLIDE-C;(+)-(1S,3R,4R,5R,6S,7R,8S)-3-CHLORO-1,4-DIHYDROXY-8-ISOVALERYLOXY-GUAI-9,11(13)-DIEN-6,12-OLIDE
SpectraBase Compound ID 4630v7p7h5u
InChI InChI=1S/C20H27ClO6/c1-9(2)6-14(22)26-12-7-10(3)20(25)8-13(21)19(5,24)17(20)16-15(12)11(4)18(23)27-16/h7,9,12-13,15-17,24-25H,4,6,8H2,1-3,5H3/t12-,13+,15+,16-,17-,19-,20+/m0/s1
InChIKey BRCXFZCYUXDGDA-OFQXIYNYSA-N
Mol Weight 398.88 g/mol
Molecular Formula C20H27ClO6
Exact Mass 398.149616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WMiLKONrsE
Name ARGYINOLIDE-C;(+)-(1S,3R,4R,5R,6S,7R,8S)-3-CHLORO-1,4-DIHYDROXY-8-ISOVALERYLOXY-GUAI-9,11(13)-DIEN-6,12-OLIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27ClO6
InChI InChI=1S/C20H27ClO6/c1-9(2)6-14(22)26-12-7-10(3)20(25)8-13(21)19(5,24)17(20)16-15(12)11(4)18(23)27-16/h7,9,12-13,15-17,24-25H,4,6,8H2,1-3,5H3/t12-,13+,15+,16-,17-,19-,20+/m0/s1
InChIKey BRCXFZCYUXDGDA-OFQXIYNYSA-N
Literature Reference Author S.WANG,J.SUN,K.ZENG,X.CHEN,W.ZHOU,C.ZHANG,H.JIN,Y.JIANG,P.TU
Literature Reference Citation EUR.J.ORG.CHEM.,2014,973(2014)
Literature Reference DOI 10.1002/ejoc.201301445
Molecular Weight 398.884 g/mol
Solvent CDCl3
Source File Reference UWIR18210