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38-HYDROXYMYCALOLIDE-B;MAJOR-ISOMER
SpectraBase Compound ID DSjPf75lap5
InChI InChI=1S/C51H72N4O17/c1-29(18-19-41(72-51(62)44(24-56)65-10)33(5)47(70-34(6)58)30(2)20-21-55(7)28-57)42(64-9)23-43-32(4)40(63-8)16-13-17-45-52-37(26-67-45)49-54-38(27-69-49)50-53-36(25-68-50)48(66-11)31(3)39(60)15-12-14-35(59)22-46(61)71-43/h12-13,15,17,20-21,25-33,35,40-44,47-48,56,59H,14,16,18-19,22-24H2,1-11H3/b15-12-,17-13-,21-20+
InChIKey WMQWIJXGKYDMAH-XLFLCJKISA-N
Mol Weight 1013.1 g/mol
Molecular Formula C51H72N4O17
Exact Mass 1012.489247 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K6YG7wL88q5
Name 38-HYDROXYMYCALOLIDE-B;MINOR-ISOMER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H72N4O17
InChI InChI=1S/C51H72N4O17/c1-29(18-19-41(72-51(62)44(24-56)65-10)33(5)47(70-34(6)58)30(2)20-21-55(7)28-57)42(64-9)23-43-32(4)40(63-8)16-13-17-45-52-37(26-67-45)49-54-38(27-69-49)50-53-36(25-68-50)48(66-11)31(3)39(60)15-12-14-35(59)22-46(61)71-43/h12-13,15,17,20-21,25-33,35,40-44,47-48,56,59H,14,16,18-19,22-24H2,1-11H3/b15-12-,17-13-,21-20+
InChIKey WMQWIJXGKYDMAH-XLFLCJKISA-N
Literature Reference Author S.MATSUNAGA,T.SUGAWARA,N.FUSETANI
Literature Reference Citation J.NAT.PROD.,61,1164(1998)
Literature Reference DOI 10.1021/np980102r
Molecular Weight 1013.149 g/mol
Solvent CD3OD
Source File Reference UWCP2163