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SULTRIECIN;5,6-DIHYDRO-5-HYDROXY-6-(6-HYDROXY-5-METHYL-4-HYDROXYSULFONYLOXYHEPTADEC-1,7,9,11-TETRAENYL)-2H-PYRAN-2-ONE-MONOSODIUM-SALT
SpectraBase Compound ID H5rdsJwkmpk
InChI InChI=1S/C23H34O8S.Na/c1-3-4-5-6-7-8-9-10-11-13-19(24)18(2)21(31-32(27,28)29)14-12-15-22-20(25)16-17-23(26)30-22;/h7-13,15-22,24-25H,3-6,14H2,1-2H3,(H,27,28,29);/q;+1/p-1/b8-7-,10-9-,13-11-,15-12+;/t18-,19?,20?,21-,22?;/m1./s1
InChIKey GAYWDMXGCWYFCK-PLGMIEFHSA-M
Mol Weight 492.6 g/mol
Molecular Formula C23H33NaO8S
Exact Mass 492.179383 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7TYzwHwOzR
Name SULTRIECIN;5,6-DIHYDRO-5-HYDROXY-6-(6-HYDROXY-5-METHYL-4-HYDROXYSULFONYLOXYHEPTADEC-1,7,9,11-TETRAENYL)-2H-PYRAN-2-ONE-MONOSODIUM-SALT
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H33NaO8S
InChI InChI=1S/C23H34O8S.Na/c1-3-4-5-6-7-8-9-10-11-13-19(24)18(2)21(31-32(27,28)29)14-12-15-22-20(25)16-17-23(26)30-22;/h7-13,15-22,24-25H,3-6,14H2,1-2H3,(H,27,28,29);/q;+1/p-1/b8-7-,10-9-,13-11-,15-12+;/t18-,19?,20?,21-,22?;/m1./s1
InChIKey GAYWDMXGCWYFCK-PLGMIEFHSA-M
Literature Reference Author H.OHKUMA,N.NARUSE,Y.NISHIYAMA,T.TSUNO,Y.HOSHINO,Y.SAWADA,M.K ONISHI,T.OKI
Literature Reference Citation J.ANTIBIOTICS,45,1239(1992)
Literature Reference DOI 10.7164/antibiotics.45.1239
Molecular Weight 492.560 g/mol
Sample ID 45935
Solvent DMSO-D6