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ALTAICALARIN_C;5-ALPHA-ACETOXY-8-ANGELOYLOXY-2-BETA,3-BETA-EPOXY-BISABOLA-7-(14),10-(11)-DIEN-4-ONE
SpectraBase Compound ID 88YZn3CXpJF
InChI InChI=1S/C22H30O6/c1-8-13(4)21(25)27-17(10-9-12(2)3)14(5)16-11-18-22(7,28-18)20(24)19(16)26-15(6)23/h8-9,16-19H,5,10-11H2,1-4,6-7H3/b13-8-/t16-,17?,18-,19-,22-/m0/s1
InChIKey DAQJZMZCFFUHCO-NAFQNHHTSA-N
Mol Weight 390.48 g/mol
Molecular Formula C22H30O6
Exact Mass 390.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2itMk98comr
Name ALTAICALARIN_C;5-ALPHA-ACETOXY-8-ANGELOYLOXY-2-BETA,3-BETA-EPOXY-BISABOLA-7-(14),10-(11)-DIEN-4-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O6
InChI InChI=1S/C22H30O6/c1-8-13(4)21(25)27-17(10-9-12(2)3)14(5)16-11-18-22(7,28-18)20(24)19(16)26-15(6)23/h8-9,16-19H,5,10-11H2,1-4,6-7H3/b13-8-/t16-,17?,18-,19-,22-/m0/s1
InChIKey DAQJZMZCFFUHCO-NAFQNHHTSA-N
Literature Reference Author Q.WANG,T.H.CHEN,K.F.BASTOW,K.H.LEE,D.F.CHEN
Literature Reference Citation J.NAT.PROD.,73,139(2010)
Literature Reference DOI 10.1021/np900489h
Molecular Weight 390.477 g/mol
Sample ID 34412
Solvent CDCl3