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LZNSOBMEKGHBCF-JUFVCXMFSA-N

View entire compound with spectra: 1 NMR

LZNSOBMEKGHBCF-JUFVCXMFSA-N
SpectraBase Compound ID Y7J4i01CBK
InChI InChI=1S/C56H72N8O12S4/c65-45(73-33-13-5-1-6-14-33)25-21-37-53-61-42(29-77-53)50(70)58-39(23-27-47(67)75-35-17-9-3-10-18-35)55-63-44(31-79-55)52(72)60-40(24-28-48(68)76-36-19-11-4-12-20-36)56-64-43(32-80-56)51(71)59-38(54-62-41(30-78-54)49(69)57-37)22-26-46(66)74-34-15-7-2-8-16-34/h29-40H,1-28H2,(H,57,69)(H,58,70)(H,59,71)(H,60,72)/t37-,38-,39-,40-/m1/s1
InChIKey LZNSOBMEKGHBCF-JUFVCXMFSA-N
Mol Weight 1177.5 g/mol
Molecular Formula C56H72N8O12S4
Exact Mass 1176.415254 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9K7LHX4dO84
Name LZNSOBMEKGHBCF-JUFVCXMFSA-N
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H72N8O12S4
InChI InChI=1S/C56H72N8O12S4/c65-45(73-33-13-5-1-6-14-33)25-21-37-53-61-42(29-77-53)50(70)58-39(23-27-47(67)75-35-17-9-3-10-18-35)55-63-44(31-79-55)52(72)60-40(24-28-48(68)76-36-19-11-4-12-20-36)56-64-43(32-80-56)51(71)59-38(54-62-41(30-78-54)49(69)57-37)22-26-46(66)74-34-15-7-2-8-16-34/h29-40H,1-28H2,(H,57,69)(H,58,70)(H,59,71)(H,60,72)/t37-,38-,39-,40-/m1/s1
InChIKey LZNSOBMEKGHBCF-JUFVCXMFSA-N
Literature Reference Author Y.SINGH,N.SOKOLENKO,M.J.KELSO,L.R.GAHAN,G.ABBENANTE,D.P.FAIR LIE
Literature Reference Citation J.AM.CHEM.SOC.,123,333(2001)
Literature Reference DOI 10.1021/ja002666z
Molecular Weight 1177.474 g/mol
Solvent CDCl3
Source File Reference UWVN28572