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2'-EPI-TUBERATOLIDE_B

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2'-EPI-TUBERATOLIDE_B
SpectraBase Compound ID ClQbLJdxAwP
InChI InChI=1S/C27H34O4/c1-18(2)8-6-10-22-17-24(30-26(22)29)14-19(3)9-7-12-27(5)13-11-21-16-23(28)15-20(4)25(21)31-27/h8-9,11,13,15-17,24,28H,6-7,10,12,14H2,1-5H3/b19-9+/t24-,27-/m1/s1
InChIKey BNWXBVSPPVIYFO-URLCLMEBSA-N
Mol Weight 422.6 g/mol
Molecular Formula C27H34O4
Exact Mass 422.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1C0XhTxn4k9
Name 2'-EPI-TUBERATOLIDE_B
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H34O4
InChI InChI=1S/C27H34O4/c1-18(2)8-6-10-22-17-24(30-26(22)29)14-19(3)9-7-12-27(5)13-11-21-16-23(28)15-20(4)25(21)31-27/h8-9,11,13,15-17,24,28H,6-7,10,12,14H2,1-5H3/b19-9+/t24-,27-/m1/s1
InChIKey BNWXBVSPPVIYFO-URLCLMEBSA-N
Literature Reference Author H.CHOI,H.HWANG,J.CHIN,E.KIM,J.LEE,S.J.NAM,B.C.LEE,B.J.RHO,H. KANG
Literature Reference Citation J.NAT.PROD.,74,90(2011)
Literature Reference DOI 10.1021/np100489u
Molecular Weight 422.565 g/mol
Sample ID 37609
Solvent CDCl3