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YIJVJFCLUNYXQX-UHFFFAOYSA-N

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YIJVJFCLUNYXQX-UHFFFAOYSA-N
SpectraBase Compound ID KAaHkNoa4C7
InChI InChI=1S/C35H32N8O7S/c1-6-17(4)25-29(45)41-24(16(2)3)28(44)36-18(5)31-37-20(12-47-31)32-39-22(14-49-32)35-40-23(15-51-35)33-38-21(13-48-33)34-43-26(30(46)42-25)27(50-34)19-10-8-7-9-11-19/h7-17,24-25H,5-6H2,1-4H3,(H,36,44)(H,41,45)(H,42,46)
InChIKey YIJVJFCLUNYXQX-UHFFFAOYSA-N
Mol Weight 708.7 g/mol
Molecular Formula C35H32N8O7S
Exact Mass 708.211467 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CabfYoBquOv
Name YIJVJFCLUNYXQX-UHFFFAOYSA-N
Compound Number MECHERCHARSTATIN_A,#1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H32N8O7S
InChI InChI=1S/C35H32N8O7S/c1-6-17(4)25-29(45)41-24(16(2)3)28(44)36-18(5)31-37-20(12-47-31)32-39-22(14-49-32)35-40-23(15-51-35)33-38-21(13-48-33)34-43-26(30(46)42-25)27(50-34)19-10-8-7-9-11-19/h7-17,24-25H,5-6H2,1-4H3,(H,36,44)(H,41,45)(H,42,46)
InChIKey YIJVJFCLUNYXQX-UHFFFAOYSA-N
Literature Reference Author K.KANOH,Y.MATSUO,K.ADACHI,H.IMAGAWA,M.NISHIZAWA,Y.SHIZURI
Literature Reference Citation J.ANTIBIOTICS,58,289(2005)
Literature Reference DOI 10.1038/ja.2005.36
Molecular Weight 708.748 g/mol
Sample ID 40
Solvent DMSO-D6