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SULFOBACIN-A;(2R,3R)-3-HYDROXY-2-[(R)-3-HYDROXY-15-METHYLHEXADECANAMIDO]-15-METHYLHEXADECANE-SULFONIC-ACID
SpectraBase Compound ID 8q0R7bla2Uk
InChI InChI=1S/C34H69NO6S/c1-29(2)23-19-15-11-7-5-9-13-17-21-25-31(36)27-34(38)35-32(28-42(39,40)41)33(37)26-22-18-14-10-6-8-12-16-20-24-30(3)4/h29-33,36-37H,5-28H2,1-4H3,(H,35,38)(H,39,40,41)/t31-,32-,33-/m0/s1
InChIKey IENDTBZONILTAG-ZDCRTTOTSA-N
Mol Weight 620.0 g/mol
Molecular Formula C34H69NO6S
Exact Mass 619.48456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GshdNqtXcW1
Name SULFOBACIN-A;(2R,3R)-3-HYDROXY-2-[(R)-3-HYDROXY-15-METHYLHEXADECANAMIDO]-15-METHYLHEXADECANE-SULFONIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H69NO6S
InChI InChI=1S/C34H69NO6S/c1-29(2)23-19-15-11-7-5-9-13-17-21-25-31(36)27-34(38)35-32(28-42(39,40)41)33(37)26-22-18-14-10-6-8-12-16-20-24-30(3)4/h29-33,36-37H,5-28H2,1-4H3,(H,35,38)(H,39,40,41)/t31-,32-,33-/m0/s1
InChIKey IENDTBZONILTAG-ZDCRTTOTSA-N
Literature Reference Author T.KAMIYAMA,T.UMINO,Y.ITEZONO,Y.NAKAMURA,T.SATOH,K.YOKOSE
Literature Reference Citation J.ANTIBIOTICS,48,929(1995)
Literature Reference DOI 10.7164/antibiotics.48.929
Molecular Weight 619.985 g/mol
Solvent DMSO-D6
Source File Reference UWCS24754