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11-BETA,13-DIHYDROAGUERIN-A;3-BETA-HYDROXY-8-ALPHA-ISOBUTYRYLOXYGUAIA-4(15),10(14)-DIEN-1-ALPHA,5-ALPHA,11-BETA-H-12,6-OLIDE

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11-BETA,13-DIHYDROAGUERIN-A;3-BETA-HYDROXY-8-ALPHA-ISOBUTYRYLOXYGUAIA-4(15),10(14)-DIEN-1-ALPHA,5-ALPHA,11-BETA-H-12,6-OLIDE
SpectraBase Compound ID BhUmii57vTl
InChI InChI=1S/C19H26O5/c1-8(2)18(21)23-14-6-9(3)12-7-13(20)10(4)15(12)17-16(14)11(5)19(22)24-17/h8,11-17,20H,3-4,6-7H2,1-2,5H3/t11-,12-,13-,14-,15-,16+,17+/m1/s1
InChIKey VKFKILXPTYWTRI-NOCMYWHHSA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6UhENSd9iFQ
Name 11-BETA,13-DIHYDROAGUERIN-A;3-BETA-HYDROXY-8-ALPHA-ISOBUTYRYLOXYGUAIA-4(15),10(14)-DIEN-1-ALPHA,5-ALPHA,11-BETA-H-12,6-OLIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-8(2)18(21)23-14-6-9(3)12-7-13(20)10(4)15(12)17-16(14)11(5)19(22)24-17/h8,11-17,20H,3-4,6-7H2,1-2,5H3/t11-,12-,13-,14-,15-,16+,17+/m1/s1
InChIKey VKFKILXPTYWTRI-NOCMYWHHSA-N
Literature Reference Author J.A.MARCO,J.F.SANZ,R.ALBIACH,A.RUSTAIYAN,Z.HABIBI
Literature Reference Citation PHYTOCHEM.,32,395(1993)
Literature Reference DOI 10.1016/S0031-9422(00)95002-7
Molecular Weight 334.412 g/mol
Solvent CDCl3
Source File Reference UWMS3667