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ent-12.beta.-Acetoxy-15.beta.-hydroxykaur-16-en-19-oic acid
SpectraBase Compound ID APzn0aOrfes
InChI InChI=1S/C22H32O5/c1-12-14-11-22(18(12)24)9-6-16-20(3,7-5-8-21(16,4)19(25)26)17(22)10-15(14)27-13(2)23/h14-18,24H,1,5-11H2,2-4H3,(H,25,26)/t14-,15+,16+,17+,18+,20-,21-,22-/m1/s1
InChIKey GPMKNKRTOWLBPI-YRZBSQLHSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I42W3FgcHOQ
Name ENT-12-BETA-ACETOXY-15-BETA-HYDROXYKAUR-16-EN-19-OIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-12-14-11-22(18(12)24)9-6-16-20(3,7-5-8-21(16,4)19(25)26)17(22)10-15(14)27-13(2)23/h14-18,24H,1,5-11H2,2-4H3,(H,25,26)/t14-,15+,16+,17+,18+,20-,21-,22-/m1/s1
InChIKey GPMKNKRTOWLBPI-YRZBSQLHSA-N
Literature Reference Author C.GASPAR-MARQUES,M.F.SIMOES,B.RODRIGUEZ
Literature Reference Citation J.NAT.PROD.,67,614(2004)
Literature Reference DOI 10.1021/np030490j
Molecular Weight 376.493 g/mol
Solvent PYRIDINE-D5
Source File Reference UWMZ7146