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TRICHODEPSIPEPTIDE_B
SpectraBase Compound ID ECuwTCCwm47
InChI InChI=1S/C35H54N4O9/c1-19(2)15-26-30(41)38-28(21(5)6)32(43)37-25(18-40)34(45)48-29(22(7)8)35(46)47-27(16-20(3)4)31(42)36-24(33(44)39(26)9)17-23-13-11-10-12-14-23/h10-14,19-22,24-29,40H,15-18H2,1-9H3,(H,36,42)(H,37,43)(H,38,41)/t24-,25-,26-,27-,28-,29-/m0/s1
InChIKey OFQBSWDOEHTKQI-AQRCPPRCSA-N
Mol Weight 674.8 g/mol
Molecular Formula C35H54N4O9
Exact Mass 674.389079 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bc5K1zWZK8C
Name TRICHODEPSIPEPTIDE_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H54N4O9
InChI InChI=1S/C35H54N4O9/c1-19(2)15-26-30(41)38-28(21(5)6)32(43)37-25(18-40)34(45)48-29(22(7)8)35(46)47-27(16-20(3)4)31(42)36-24(33(44)39(26)9)17-23-13-11-10-12-14-23/h10-14,19-22,24-29,40H,15-18H2,1-9H3,(H,36,42)(H,37,43)(H,38,41)/t24-,25-,26-,27-,28-,29-/m0/s1
InChIKey OFQBSWDOEHTKQI-AQRCPPRCSA-N
Literature Reference Author A.A.SY-CORDERO,T.N.GRAF,A.F.ADCOCK,D.J.KROLL,Q.SHEN,S.M.SWAN SON,M.C.WANI,C.J.PEA
Literature Reference Citation J.NAT.PROD.,74,2137(2011)
Literature Reference DOI 10.1021/np2004243
Molecular Weight 674.835 g/mol
Sample ID 39374
Solvent CDCl3