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DOITUNGGARCINONE_B

View entire compound with spectra: 1 NMR

DOITUNGGARCINONE_B
SpectraBase Compound ID J7xUUM1N2SM
InChI InChI=1S/C33H42O4/c1-21(2)13-14-25-19-32(18-16-23(5)6)29(36)31(17-15-22(3)4)20-30(25,7)33(32,37)26(28(31)35)27(34)24-11-9-8-10-12-24/h8-13,15,25,34,37H,5,14,16-20H2,1-4,6-7H3/b27-26+/t25-,30-,31-,32-,33+/m1/s1
InChIKey JGCUNVGYWDYISJ-VDFYCWRWSA-N
Mol Weight 502.7 g/mol
Molecular Formula C33H42O4
Exact Mass 502.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GzXnCGPl9eI
Name DOITUNGGARCINONE_B
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H42O4
InChI InChI=1S/C33H42O4/c1-21(2)13-14-25-19-32(18-16-23(5)6)29(36)31(17-15-22(3)4)20-30(25,7)33(32,37)26(28(31)35)27(34)24-11-9-8-10-12-24/h8-13,15,25,34,37H,5,14,16-20H2,1-4,6-7H3/b27-26+/t25-,30-,31-,32-,33+/m1/s1
InChIKey JGCUNVGYWDYISJ-VDFYCWRWSA-N
Literature Reference Author C.TANTAPAKUL,W.PHAKHODEE,T.RITTHIWIGROM,S.CHEENPRACHA,U.PRAW AT,S.DEACHATHAI,S.LA
Literature Reference Citation J.NAT.PROD.,75,1660(2012)
Literature Reference DOI 10.1021/np300487w
Molecular Weight 502.694 g/mol
Sample ID 41485
Solvent CDCl3