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GANOSINENSIN-A;GANODERMANONTRIOL-26-O-(2Z,5E,9E)-2-[2-(2,5-DIHYDROXYPHENYL)-2-OXO-ETHYLIDENE]-11-HYDROXY-6,10-DIMETHYLUNDECA-5,9-DIENATE
SpectraBase Compound ID DAfgm3lGb9I
InChI InChI=1S/C51H72O9/c1-32(12-10-14-33(2)30-52)13-11-15-35(28-42(55)37-29-36(53)17-19-41(37)54)46(58)60-31-51(9,59)45(57)21-16-34(3)38-22-26-50(8)40-18-20-43-47(4,5)44(56)24-25-48(43,6)39(40)23-27-49(38,50)7/h13-14,17-19,23,28-29,34,38,43,45,52-54,57,59H,10-12,15-16,20-22,24-27,30-31H2,1-9H3/b32-13+,33-14+,35-28-/t34-,38-,43+,45+,48-,49-,50+,51?/m1/s1
InChIKey VAEJXEVKHVVLMH-CGHNYTFVSA-N
Mol Weight 829.1 g/mol
Molecular Formula C51H72O9
Exact Mass 828.517634 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8mPb2PDadjP
Name GANOSINENSIN_A;GANODERMANONTRIOL_26-O-{(2-Z,5-E,9-E)-2-[2-(2,5-DIHYDROXYPHENYL)-2-OXO-ETHYLIDENE]-11-HYDROXY-6,10-DIMETHYLUNDECA-5,9-DIENATE}
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H72O9
InChI InChI=1S/C51H72O9/c1-32(12-10-14-33(2)30-52)13-11-15-35(28-42(55)37-29-36(53)17-19-41(37)54)46(58)60-31-51(9,59)45(57)21-16-34(3)38-22-26-50(8)40-18-20-43-47(4,5)44(56)24-25-48(43,6)39(40)23-27-49(38,50)7/h13-14,17-19,23,28-29,34,38,43,45,52-54,57,59H,10-12,15-16,20-22,24-27,30-31H2,1-9H3/b32-13+,33-14+,35-28-/t34-,38-,43+,45+,48-,49-,50+,51?/m1/s1
InChIKey VAEJXEVKHVVLMH-CGHNYTFVSA-N
Literature Reference Author N.SATO,C.M.MA,K.KOMATSU,M.HATTORI
Literature Reference Citation J.NAT.PROD.,72,958(2009)
Literature Reference DOI 10.1021/np800687t
Molecular Weight 829.127 g/mol
Sample ID 32628
Solvent CDCl3