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SESQUICILLIN_D

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SESQUICILLIN_D
SpectraBase Compound ID 2LVmZKQBInA
InChI InChI=1S/C29H42O6/c1-16(2)23(31)11-13-29(8)24-10-9-17(3)22(28(24,7)14-12-25(29)35-20(6)30)15-21-26(32)18(4)19(5)34-27(21)33/h22-25,31-32H,1,3,9-15H2,2,4-8H3/t22-,23?,24-,25+,28-,29+/m1/s1
InChIKey UCNIKIQFSZAFQI-LJXXBEORSA-N
Mol Weight 486.6 g/mol
Molecular Formula C29H42O6
Exact Mass 486.298139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eb8vrxajEgu
Name SESQUICILLIN_D
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O6
InChI InChI=1S/C29H42O6/c1-16(2)23(31)11-13-29(8)24-10-9-17(3)22(28(24,7)14-12-25(29)35-20(6)30)15-21-26(32)18(4)19(5)34-27(21)33/h22-25,31-32H,1,3,9-15H2,2,4-8H3/t22-,23?,24-,25+,28-,29+/m1/s1
InChIKey UCNIKIQFSZAFQI-LJXXBEORSA-N
Literature Reference Author R.UCHIDA,R.IMASATO,Y.YAMAGUCHI,R.MASUMA,K.SHIOMI,H.TOMODA,S. OMURA
Literature Reference Citation J.ANTIBIOTICS,58,397(2005)
Literature Reference DOI 10.1038/ja.2005.50
Molecular Weight 486.649 g/mol
Sample ID 67
Solvent CD3OD