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SESQUICILLIN_C

View entire compound with spectra: 1 NMR

SESQUICILLIN_C
SpectraBase Compound ID 8Pq9r0ML9fD
InChI InChI=1S/C29H42O6/c1-17(16-30)9-8-13-29(7)24-11-10-18(2)23(28(24,6)14-12-25(29)35-21(5)31)15-22-26(32)19(3)20(4)34-27(22)33/h9,23-25,30,32H,2,8,10-16H2,1,3-7H3/b17-9+/t23-,24-,25+,28-,29+/m1/s1
InChIKey RGLORAMZMUVQIN-KDTXZPBHSA-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 ECr7UcNgmqS
Name SESQUICILLIN_C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O6
InChI InChI=1S/C29H42O6/c1-17(16-30)9-8-13-29(7)24-11-10-18(2)23(28(24,6)14-12-25(29)35-21(5)31)15-22-26(32)19(3)20(4)34-27(22)33/h9,23-25,30,32H,2,8,10-16H2,1,3-7H3/b17-9+/t23-,24-,25+,28-,29+/m1/s1
InChIKey RGLORAMZMUVQIN-KDTXZPBHSA-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 66
Solvent CD3OD