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MEEHANINE_I;ISOMER_1
SpectraBase Compound ID GygCuTAbae2
InChI InChI=1S/C38H61N3O14/c1-6-20(3)35(49)41-16-8-14-40-28(43)17-26(39-15-13-24(42)18-41)23-9-11-25(12-10-23)53-38-34(32(47)29(44)22(5)52-38)55-37-33(48)31(46)30(45)27(54-37)19-51-36(50)21(4)7-2/h9-12,20-22,24,26-27,29-34,37-39,42,44-48H,6-8,13-19H2,1-5H3,(H,40,43)/t20-,21+,22-,24+,26-,27+,29-,30+,31-,32+,33+,34+,37-,38-/m0/s1
InChIKey LAKJMQZPQITUGL-FDMGOOOKSA-N
Mol Weight 783.9 g/mol
Molecular Formula C38H61N3O14
Exact Mass 783.415354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7T3HmdyZcJ7
Name MEEHANINE_I;ISOMER_2
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H61N3O14
InChI InChI=1S/C38H61N3O14/c1-6-20(3)35(49)41-16-8-14-40-28(43)17-26(39-15-13-24(42)18-41)23-9-11-25(12-10-23)53-38-34(32(47)29(44)22(5)52-38)55-37-33(48)31(46)30(45)27(54-37)19-51-36(50)21(4)7-2/h9-12,20-22,24,26-27,29-34,37-39,42,44-48H,6-8,13-19H2,1-5H3,(H,40,43)/t20-,21+,22-,24+,26-,27+,29-,30+,31-,32+,33+,34+,37-,38-/m0/s1
InChIKey LAKJMQZPQITUGL-FDMGOOOKSA-N
Literature Reference Author T.MURATA,T.MIYASE,T.WARASHINA,F.YOSHIZAKI
Literature Reference Citation J.NAT.PROD.,72,1049(2009)
Literature Reference DOI 10.1021/np800691k
Molecular Weight 783.914 g/mol
Sample ID 32735
Solvent CD3OD