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MYRTUCOMMULONE_D

View entire compound with spectra: 1 NMR

MYRTUCOMMULONE_D
SpectraBase Compound ID Xn6q18fRJL
InChI InChI=1S/C38H50O9/c1-15(2)18-20-26(40)23(25(39)17(5)6)28-21(27(20)46-31-22(18)29(41)34(7,8)32(43)36(31,11)12)19(16(3)4)24-30(42)35(9,10)33(44)37(13,14)38(24,45)47-28/h15-19,24,40,45H,1-14H3/t18-,19-,24-,38+/m1/s1
InChIKey ITNDAFZKMDPQMX-GGJZBEBTSA-N
Mol Weight 650.8 g/mol
Molecular Formula C38H50O9
Exact Mass 650.345483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KP9dbziZjlw
Name MYRTUCOMMULONE_D
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H50O9
InChI InChI=1S/C38H50O9/c1-15(2)18-20-26(40)23(25(39)17(5)6)28-21(27(20)46-31-22(18)29(41)34(7,8)32(43)36(31,11)12)19(16(3)4)24-30(42)35(9,10)33(44)37(13,14)38(24,45)47-28/h15-19,24,40,45H,1-14H3/t18-,19-,24-,38+/m1/s1
InChIKey ITNDAFZKMDPQMX-GGJZBEBTSA-N
Literature Reference Author A.R.CARROLL,J.LAMB,R.MONI,G.P.GUYMER,P.I.FORSTER,R.J.QUINN
Literature Reference Citation J.NAT.PROD.,71,1564(2008)
Literature Reference DOI 10.1021/np800247u
Molecular Weight 650.810 g/mol
Sample ID 29041
Solvent C6D6