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7-ALPHA,23-DIHYDROXY-3-OXO-24,25,26,27-TETRANORAPOTIRUCALL-1,14,20(22)-TRIEN-21,23-OLIDE
SpectraBase Compound ID GUbFXZbapdN
InChI InChI=1S/2C26H34O5/c2*1-23(2)18-13-20(28)26(5)16-7-6-15(14-12-21(29)31-22(14)30)24(16,3)10-8-17(26)25(18,4)11-9-19(23)27/h2*7,9,11-12,15,17-18,20-21,28-29H,6,8,10,13H2,1-5H3/t2*15-,17?,18?,20+,21?,24-,25+,26-/m00/s1
InChIKey XYHGOBYFAMRSSC-OIBFFRSFSA-N
Mol Weight 853.1 g/mol
Molecular Formula C52H68O10
Exact Mass 852.481248 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1BHHAi6dsFh
Name 7-ALPHA,23-DIHYDROXY-3-OXO-24,25,26,27-TETRANORAPOTIRUCALL-1,14,20(22)-TRIEN-21,23-OLIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H68O10
InChI InChI=1S/2C26H34O5/c2*1-23(2)18-13-20(28)26(5)16-7-6-15(14-12-21(29)31-22(14)30)24(16,3)10-8-17(26)25(18,4)11-9-19(23)27/h2*7,9,11-12,15,17-18,20-21,28-29H,6,8,10,13H2,1-5H3/t2*15-,17?,18?,20+,21?,24-,25+,26-/m00/s1
InChIKey XYHGOBYFAMRSSC-OIBFFRSFSA-N
Literature Reference Author D.A.G.CORTEZ,J.B.FERNANDES,P.C.VIERIA,M.F.D.G.F.D.SILVA,A.G. FERREIRA,Q.B.CASS,J.
Literature Reference Citation PHYTOCHEM.,49,2493(1998)
Literature Reference DOI 10.1016/S0031-9422(98)00234-9
Molecular Weight 853.106 g/mol
Solvent CDCl3
Source File Reference UWLU1101