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SESQUICILLIN_B

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SESQUICILLIN_B
SpectraBase Compound ID AvT8YpLr2Xn
InChI InChI=1S/C29H40O7/c1-16-10-11-23-28(6,22(16)15-21-25(31)18(3)19(4)35-27(21)34)14-12-24(36-20(5)30)29(23,7)13-8-9-17(2)26(32)33/h9,22-24,31H,1,8,10-15H2,2-7H3,(H,32,33)/b17-9+/t22-,23-,24+,28-,29+/m1/s1
InChIKey XDFBIURKLOXORC-IWTCPMMNSA-N
Mol Weight 500.6 g/mol
Molecular Formula C29H40O7
Exact Mass 500.277404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8x4dE4reej2
Name SESQUICILLIN_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H40O7
InChI InChI=1S/C29H40O7/c1-16-10-11-23-28(6,22(16)15-21-25(31)18(3)19(4)35-27(21)34)14-12-24(36-20(5)30)29(23,7)13-8-9-17(2)26(32)33/h9,22-24,31H,1,8,10-15H2,2-7H3,(H,32,33)/b17-9+/t22-,23-,24+,28-,29+/m1/s1
InChIKey XDFBIURKLOXORC-IWTCPMMNSA-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 500.632 g/mol
Sample ID 65
Solvent CD3OD