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22,27-DINOR-ZYGGOMPHIC_ACID_B

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22,27-DINOR-ZYGGOMPHIC_ACID_B
SpectraBase Compound ID 5nlLB7Mbt3Y
InChI InChI=1S/C25H30O2/c1-17-15-18(2)22-21(17)19(3)16-24(4,25(22,5)23(26)27)14-10-9-13-20-11-7-6-8-12-20/h6-17,21-22H,1-5H3,(H,26,27)/b13-9+,14-10+/t17-,21-,22+,24+,25+/m1/s1
InChIKey KNDMYWMVTUEPLZ-MACPZBPUSA-N
Mol Weight 362.51 g/mol
Molecular Formula C25H30O2
Exact Mass 362.22458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GcdMAIKe2Tm
Name 22,27-DINOR-ZYGGOMPHIC_ACID_B
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O2
InChI InChI=1S/C25H30O2/c1-17-15-18(2)22-21(17)19(3)16-24(4,25(22,5)23(26)27)14-10-9-13-20-11-7-6-8-12-20/h6-17,21-22H,1-5H3,(H,26,27)/b13-9+,14-10+/t17-,21-,22+,24+,25+/m1/s1
InChIKey KNDMYWMVTUEPLZ-MACPZBPUSA-N
Literature Reference Author S.ANKISETTY,D.J.GOCHFELD,M.C.DIAZ,S.I.KHAN,M.SLATTERY
Literature Reference Citation J.NAT.PROD.,73,1494(2010)
Literature Reference DOI 10.1021/np100233d
Molecular Weight 362.512 g/mol
Sample ID 36298
Solvent CDCl3