John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=K80LvHtw7q SpectraBase Spectrum ID=114UAIR8PW0

(accessed ).
HYPERIELLIPTONE_HA;6-HYDROXY-7-(2-HYDROXY-5-ISOPROPENYL-2-METHYLCYCLOPENTYLMETHYL)-2-(1-HYDROXY-1-METHYLETHYL)-3A-METHYL-5-(2-METHYLBUTYRYL)-3,3A-
SpectraBase Compound ID K80LvHtw7q
InChI InChI=1S/C27H40O6/c1-9-15(4)21(28)20-22(29)17(12-18-16(14(2)3)10-11-27(18,8)32)24-26(7,23(20)30)13-19(33-24)25(5,6)31/h15-16,18-19,29,31-32H,2,9-13H2,1,3-8H3/t15?,16-,18+,19-,26+,27-/m1/s1
InChIKey KMJCWFAYJOKUHH-PFKIYXQCSA-N
Mol Weight 460.6 g/mol
Molecular Formula C27H40O6
Exact Mass 460.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 114UAIR8PW0
Name HYPERIELLIPTONE_HA;6-HYDROXY-7-(2-HYDROXY-5-ISOPROPENYL-2-METHYLCYCLOPENTYLMETHYL)-2-(1-HYDROXY-1-METHYLETHYL)-3A-METHYL-5-(2-METHYLBUTYRYL)-3,3A-
Compound Number 1A
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O6
InChI InChI=1S/C27H40O6/c1-9-15(4)21(28)20-22(29)17(12-18-16(14(2)3)10-11-27(18,8)32)24-26(7,23(20)30)13-19(33-24)25(5,6)31/h15-16,18-19,29,31-32H,2,9-13H2,1,3-8H3/t15?,16-,18+,19-,26+,27-/m1/s1
InChIKey KMJCWFAYJOKUHH-PFKIYXQCSA-N
Literature Reference Author C.C.WU,M.H.YEN,S.C.YANG,C.N.LIN
Literature Reference Citation J.NAT.PROD.,71,1027(2008)
Literature Reference DOI 10.1021/np8001145
Molecular Weight 460.611 g/mol
Sample ID 28083
Solvent ACETONE-D6
SpectraBase Batch ID LH40TMoJDDe