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MYCOTRIENIN-I
SpectraBase Compound ID FMBSDeQd7l6
InChI InChI=1S/C36H48N2O8/c1-23-14-13-17-27-20-28(39)21-30(34(27)42)38-32(40)22-29(45-4)18-11-6-5-7-12-19-31(24(2)33(23)41)46-36(44)25(3)37-35(43)26-15-9-8-10-16-26/h5-7,11-12,14,18,20-21,24-26,29,31,33,41H,8-10,13,15-17,19,22H2,1-4H3,(H,37,43)(H,38,40)/b6-5+,12-7+,18-11+,23-14-
InChIKey WWUVMHRJRCRFSL-YFQVXFPISA-N
Mol Weight 636.8 g/mol
Molecular Formula C36H48N2O8
Exact Mass 636.341067 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jmr4cxT8ZEq
Name MYCOTRIENIN_I
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H48N2O8
InChI InChI=1S/C36H48N2O8/c1-23-14-13-17-27-20-28(39)21-30(34(27)42)38-32(40)22-29(45-4)18-11-6-5-7-12-19-31(24(2)33(23)41)46-36(44)25(3)37-35(43)26-15-9-8-10-16-26/h5-7,11-12,14,18,20-21,24-26,29,31,33,41H,8-10,13,15-17,19,22H2,1-4H3,(H,37,43)(H,38,40)/b6-5+,12-7+,18-11+,23-14-
InChIKey WWUVMHRJRCRFSL-YFQVXFPISA-N
Literature Reference Author T.KAWAMURA,E.TASHIRO,K.YAMAMOTO,K.SHINDO,M.IMOTO
Literature Reference Citation J.ANTIBIOTICS,61,303(2008)
Literature Reference DOI 10.1038/ja.2008.43
Molecular Weight 636.786 g/mol
Solvent CDCl3
Source File Reference UWMB165