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1-ALPHA,7-ALPHA,14-BETA,15-BETA-TETRAHYDROXY-3-BETA-ACETOXY-ENT-KAUR-16-EN-12-ONE
SpectraBase Compound ID 29rJBPhDFtd
InChI InChI=1S/C22H32O7/c1-9-17-11(24)6-13-21(5)12(7-15(26)22(13,18(9)27)19(17)28)20(3,4)16(8-14(21)25)29-10(2)23/h12-19,25-28H,1,6-8H2,2-5H3/t12-,13+,14+,15-,16+,17-,18-,19-,21-,22+/m1/s1
InChIKey XNEVKRBXUHLYDL-YLRRAFMMSA-N
Mol Weight 408.5 g/mol
Molecular Formula C22H32O7
Exact Mass 408.214803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3rXnysD0IIP
Name 1-ALPHA,7-ALPHA,14-BETA,15-BETA-TETRAHYDROXY-3-BETA-ACETOXY-ENT-KAUR-16-EN-12-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O7
InChI InChI=1S/C22H32O7/c1-9-17-11(24)6-13-21(5)12(7-15(26)22(13,18(9)27)19(17)28)20(3,4)16(8-14(21)25)29-10(2)23/h12-19,25-28H,1,6-8H2,2-5H3/t12-,13+,14+,15-,16+,17-,18-,19-,21-,22+/m1/s1
InChIKey XNEVKRBXUHLYDL-YLRRAFMMSA-N
Literature Reference Author Y.ZHAO,J.X.PU,S.X.HUANG,L.S.DING,Y.L.WU,X.LI,L.B.YANG,W.L.XI AO,G.Q.CHEN,H.D.SUN
Literature Reference Citation J.NAT.PROD.,72,988(2009)
Literature Reference DOI 10.1021/np9000366
Molecular Weight 408.492 g/mol
Sample ID 32659
Solvent ACETONE-D6