John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=IO6iJH4QCI5 SpectraBase Spectrum ID=664yhw9XP35

(accessed ).
AVZWBTNFMAUZIC-CYPSKNEPSA-N
SpectraBase Compound ID IO6iJH4QCI5
InChI InChI=1S/C30H47N3O5S/c1-22-10-11-26-27(9-6-14-29(26,2)3)30(22,4)15-12-23(20-38-39(35,36)37)7-5-8-24-17-28(34)33(19-24)16-13-25-18-31-21-32-25/h9,17-18,21-23,26H,5-8,10-16,19-20H2,1-4H3,(H,31,32)(H,35,36,37)/t22-,23?,26-,30-/m0/s1
InChIKey AVZWBTNFMAUZIC-CYPSKNEPSA-N
Mol Weight 561.8 g/mol
Molecular Formula C30H47N3O5S
Exact Mass 561.323644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 664yhw9XP35
Name AVZWBTNFMAUZIC-CYPSKNEPSA-N
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H47N3O5S
InChI InChI=1S/C30H47N3O5S/c1-22-10-11-26-27(9-6-14-29(26,2)3)30(22,4)15-12-23(20-38-39(35,36)37)7-5-8-24-17-28(34)33(19-24)16-13-25-18-31-21-32-25/h9,17-18,21-23,26H,5-8,10-16,19-20H2,1-4H3,(H,31,32)(H,35,36,37)/t22-,23?,26-,30-/m0/s1
InChIKey AVZWBTNFMAUZIC-CYPSKNEPSA-N
Literature Reference Author G.YAO,T.P.KONDRATYUK,G.T.TAN,J.M.PEZZUTO,L.C.CHANG
Literature Reference Citation J.NAT.PROD.,72,319(2009)
Literature Reference DOI 10.1021/np8005343
Molecular Weight 561.780 g/mol
Sample ID 32238
Solvent CD3OD
SpectraBase Batch ID 5rHGhjamsqw