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21,22-Di-O-angeloyl-R1-barrigenol

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21,22-Di-O-angeloyl-R1-barrigenol
SpectraBase Compound ID IbnIowRtCed
InChI InChI=1S/C40H64O8/c1-12-23(4)34(45)47-32-33(48-35(46)24(5)13-2)40(22-41)28(21-36(32,6)7)27-17-15-25(14-3)38(10,39(27,11)30(43)31(40)44)20-19-26-16-18-29(42)37(26,8)9/h12-13,17,25-26,28-33,41-44H,14-16,18-22H2,1-11H3/b23-12-,24-13-
InChIKey LQQAGGREBSMUOM-KBZHBASMSA-N
Mol Weight 672.9 g/mol
Molecular Formula C40H64O8
Exact Mass 672.460119 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KCelN9Wm0y3
Name 21,22-DI-O-ANGELOYL-R1-BARRIGENOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H64O8
InChI InChI=1S/C40H64O8/c1-12-23(4)34(45)47-32-33(48-35(46)24(5)13-2)40(22-41)28(21-36(32,6)7)27-17-15-25(14-3)38(10,39(27,11)30(43)31(40)44)20-19-26-16-18-29(42)37(26,8)9/h12-13,17,25-26,28-33,41-44H,14-16,18-22H2,1-11H3/b23-12-,24-13-
InChIKey LQQAGGREBSMUOM-KBZHBASMSA-N
Literature Reference Author Y.CHEN,T.TAKEDA,Y.OGIHARA
Literature Reference Citation CHEM.PHARM.BULL.,33,127(1985)
Literature Reference DOI 10.1248/cpb.33.127
Molecular Weight 672.943 g/mol
Solvent PYRIDINE-D5
Source File Reference UWBK193