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Barringtogenol-C
SpectraBase Compound ID GSAhb0EM3D
InChI InChI=1S/C30H50O5/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(32)26(3,4)19(27)10-13-28(20,6)29(17,7)15-22(33)30(18,16-31)24(35)23(25)34/h8,18-24,31-35H,9-16H2,1-7H3/t18-,19-,20+,21-,22+,23-,24-,27-,28+,29-,30-/m0/s1
InChIKey AYDKOFQQBHRXEW-UDWHUHSHSA-N
Mol Weight 490.7 g/mol
Molecular Formula C30H50O5
Exact Mass 490.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7h3qDO3peZv
Name BARRINGTOGENOL-C
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O5
InChI InChI=1S/C30H50O5/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(32)26(3,4)19(27)10-13-28(20,6)29(17,7)15-22(33)30(18,16-31)24(35)23(25)34/h8,18-24,31-35H,9-16H2,1-7H3/t18-,19-,20+,21-,22+,23-,24-,27-,28+,29-,30-/m0/s1
InChIKey AYDKOFQQBHRXEW-UDWHUHSHSA-N
Literature Reference Author G.MASSIOT,X.F.CHEN,C.LAVAUD,L.L.MEN-OLIVIER,C.DELAUDE,A.VIAR I,P.VIGNY,J.DUVAL
Literature Reference Citation PHYTOCHEM.,31,3571(1992)
Literature Reference DOI 10.1016/0031-9422(92)83729-I
Molecular Weight 490.724 g/mol
Solvent CDCl3:CD3OD=1:1
Source File Reference UWMS27186