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1-BETA,8-DIANGELOYLOXY-3-BETA,4-BETA,10,11-DIEPOXY-BISABOL-7-(14)-ENE
SpectraBase Compound ID G5bHfmgOEi4
InChI InChI=1S/C25H36O6/c1-9-14(3)22(26)28-18(12-20-24(6,7)30-20)16(5)17-11-21-25(8,31-21)13-19(17)29-23(27)15(4)10-2/h9-10,17-21H,5,11-13H2,1-4,6-8H3/b14-9-,15-10-/t17-,18?,19-,20?,21-,25+/m1/s1
InChIKey RYCPLJPOJZTHII-IOINDQDPSA-N
Mol Weight 432.6 g/mol
Molecular Formula C25H36O6
Exact Mass 432.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Q2xsMQPpDX
Name 1-BETA,8-DIANGELOYLOXY-3-BETA,4-BETA,10,11-DIEPOXY-BISABOL-7-(14)-ENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O6
InChI InChI=1S/C25H36O6/c1-9-14(3)22(26)28-18(12-20-24(6,7)30-20)16(5)17-11-21-25(8,31-21)13-19(17)29-23(27)15(4)10-2/h9-10,17-21H,5,11-13H2,1-4,6-8H3/b14-9-,15-10-/t17-,18?,19-,20?,21-,25+/m1/s1
InChIKey RYCPLJPOJZTHII-IOINDQDPSA-N
Literature Reference Author C.M.LIU,D.Q.FEI,Q.H.WU,K.GAO
Literature Reference Citation J.NAT.PROD.,69,695(2006)
Literature Reference DOI 10.1021/np0505061
Molecular Weight 432.557 g/mol
Solvent CDCl3
Source File Reference UWMZ18318