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MEEHANINE_H;ISOMER_1
SpectraBase Compound ID 2KABLi2dzBX
InChI InChI=1S/C40H63N3O15/c1-7-21(3)37(51)43-17-9-15-42-30(45)18-28(41-16-14-27(19-43)55-24(6)44)25-10-12-26(13-11-25)56-40-36(34(49)31(46)23(5)54-40)58-39-35(50)33(48)32(47)29(57-39)20-53-38(52)22(4)8-2/h10-13,21-23,27-29,31-36,39-41,46-50H,7-9,14-20H2,1-6H3,(H,42,45)/t21-,22+,23+,27+,28-,29-,31+,32-,33+,34-,35-,36-,39+,40+/m0/s1
InChIKey LXGWJPNZPSTWBA-PUMXIESVSA-N
Mol Weight 825.9 g/mol
Molecular Formula C40H63N3O15
Exact Mass 825.425918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LiuaEmVI2C4
Name MEEHANINE_H;ISOMER_2
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H63N3O15
InChI InChI=1S/C40H63N3O15/c1-7-21(3)37(51)43-17-9-15-42-30(45)18-28(41-16-14-27(19-43)55-24(6)44)25-10-12-26(13-11-25)56-40-36(34(49)31(46)23(5)54-40)58-39-35(50)33(48)32(47)29(57-39)20-53-38(52)22(4)8-2/h10-13,21-23,27-29,31-36,39-41,46-50H,7-9,14-20H2,1-6H3,(H,42,45)/t21-,22+,23+,27+,28-,29-,31+,32-,33+,34-,35-,36-,39+,40+/m0/s1
InChIKey LXGWJPNZPSTWBA-PUMXIESVSA-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 825.951 g/mol
Sample ID 32733
Solvent CD3OD