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ISOABIETENIN_A;7-ALPHA,18-DIHYDROXY-1-ALPHA,11-EPOXYABIETA-8,11,13-TRIENE
SpectraBase Compound ID AZ76rxlBm8V
InChI InChI=1S/C20H28O3/c1-11(2)12-7-13-14(22)9-16-19(3,10-21)6-5-17-20(16,4)18(13)15(8-12)23-17/h7-8,11,14,16-17,21-22H,5-6,9-10H2,1-4H3/t14-,16+,17+,19+,20-/m1/s1
InChIKey GCVSQQORMBIOEJ-MTMXWMHZSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 44vLIYNQwtO
Name ISOABIETENIN_A;7-ALPHA,18-DIHYDROXY-1-ALPHA,11-EPOXYABIETA-8,11,13-TRIENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-11(2)12-7-13-14(22)9-16-19(3,10-21)6-5-17-20(16,4)18(13)15(8-12)23-17/h7-8,11,14,16-17,21-22H,5-6,9-10H2,1-4H3/t14-,16+,17+,19+,20-/m1/s1
InChIKey GCVSQQORMBIOEJ-MTMXWMHZSA-N
Literature Reference Author J.H.YANG,X.DU,F.HE,H.B.ZHANG,X.N.LI,J.SU,Y.LI,J.X.PU,H.D.SUN
Literature Reference Citation J.NAT.PROD.,76,256(2013)
Literature Reference DOI 10.1021/np300772e
Molecular Weight 316.441 g/mol
Sample ID 42204
Solvent ACETONE-D6