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9-O-PALMITYLISOAAPTAMINE
SpectraBase Compound ID K1f29kwICgW
InChI InChI=1S/C29H42N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(32)34-29-25(33-3)22-23-18-20-30-24-19-21-31(2)28(29)27(23)24/h18-22H,4-17H2,1-3H3
InChIKey VMXRQWBZDXMLMY-UHFFFAOYSA-N
Mol Weight 466.7 g/mol
Molecular Formula C29H42N2O3
Exact Mass 466.319543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JkudsoCMbbd
Name 9-O-PALMITYLISOAAPTAMINE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42N2O3
InChI InChI=1S/C29H42N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(32)34-29-25(33-3)22-23-18-20-30-24-19-21-31(2)28(29)27(23)24/h18-22H,4-17H2,1-3H3
InChIKey VMXRQWBZDXMLMY-UHFFFAOYSA-N
Literature Reference Author Y.C.SHEN,T.T.LIN,J.H.SHEU,C.Y.DUH
Literature Reference Citation J.NAT.PROD.,62,1264(1999)
Literature Reference DOI 10.1021/np990156g
Molecular Weight 466.664 g/mol
Solvent CDCl3